Large quantifies of online user activity data, such as weekly web search volumes, which co-evolve with the mutual influence of several queries and locations, serve as an important social sensor. It is an important task to accurately forecast the future activity by discovering latent interactions from such data, i.e., the ecosystems between each query and the flow of influences between each area. However, this is a difficult problem in terms of data quantity and complex patterns covering the dynamics. To tackle the problem, we propose FluxCube, which is an effective mining method that forecasts large collections of co-evolving online user activity and provides good interpretability. Our model is the expansion of a combination of two mathematical models: a reaction-diffusion system provides a framework for modeling the flow of influences between local area groups and an ecological system models the latent interactions between each query. Also, by leveraging the concept of physics-informed neural networks, FluxCube achieves high interpretability obtained from the parameters and high forecasting performance, together. Extensive experiments on real datasets showed that FluxCube outperforms comparable models in terms of the forecasting accuracy, and each component in FluxCube contributes to the enhanced performance. We then show some case studies that FluxCube can extract useful latent interactions between queries and area groups.  ( 3 min )

This work presents solutions to the Traveling Salesperson Problem with precedence constraints (TSPPC) using Deep Reinforcement Learning (DRL) by adapting recent approaches that work well for regular TSPs. Common to these approaches is the use of graph models based on multi-head attention (MHA) layers. One idea for solving the pickup and delivery problem (PDP) is using heterogeneous attentions to embed the different possible roles each node can take. In this work, we generalize this concept of heterogeneous attentions to the TSPPC. Furthermore, we adapt recent ideas to sparsify attentions for better scalability. Overall, we contribute to the research community through the application and evaluation of recent DRL methods in solving the TSPPC.  ( 2 min )

As learning difficulty is crucial for machine learning (e.g., difficulty-based weighting learning strategies), previous literature has proposed a number of learning difficulty measures. However, no comprehensive investigation for learning difficulty is available to date, resulting in that nearly all existing measures are heuristically defined without a rigorous theoretical foundation. In addition, there is no formal definition of easy and hard samples even though they are crucial in many studies. This study attempts to conduct a pilot theoretical study for learning difficulty of samples. First, a theoretical definition of learning difficulty is proposed on the basis of the bias-variance trade-off theory on generalization error. Theoretical definitions of easy and hard samples are established on the basis of the proposed definition. A practical measure of learning difficulty is given as well inspired by the formal definition. Second, the properties for learning difficulty-based weighting strategies are explored. Subsequently, several classical weighting methods in machine learning can be well explained on account of explored properties. Third, the proposed measure is evaluated to verify its reasonability and superiority in terms of several main difficulty factors. The comparison in these experiments indicates that the proposed measure significantly outperforms the other measures throughout the experiments.  ( 3 min )

Many real-world data can be modeled as 3D graphs, but learning representations that incorporates 3D information completely and efficiently is challenging. Existing methods either use partial 3D information, or suffer from excessive computational cost. To incorporate 3D information completely and efficiently, we propose a novel message passing scheme that operates within 1-hop neighborhood. Our method guarantees full completeness of 3D information on 3D graphs by achieving global and local completeness. Notably, we propose the important rotation angles to fulfill global completeness. Additionally, we show that our method is orders of magnitude faster than prior methods. We provide rigorous proof of completeness and analysis of time complexity for our methods. As molecules are in essence quantum systems, we build the \underline{com}plete and \underline{e}fficient graph neural network (ComENet) by combing quantum inspired basis functions and the proposed message passing scheme. Experimental results demonstrate the capability and efficiency of ComENet, especially on real-world datasets that are large in both numbers and sizes of graphs. Our code is publicly available as part of the DIG library (\url{https://github.com/divelab/DIG}).  ( 2 min )

Recurrent State-space models (RSSMs) are highly expressive models for learning patterns in time series data and system identification. However, these models assume that the dynamics are fixed and unchanging, which is rarely the case in real-world scenarios. Many control applications often exhibit tasks with similar but not identical dynamics which can be modeled as a latent variable. We introduce the Hidden Parameter Recurrent State Space Models (HiP-RSSMs), a framework that parametrizes a family of related dynamical systems with a low-dimensional set of latent factors. We present a simple and effective way of learning and performing inference over this Gaussian graphical model that avoids approximations like variational inference. We show that HiP-RSSMs outperforms RSSMs and competing multi-task models on several challenging robotic benchmarks both on real-world systems and simulations.  ( 2 min )

Fluid-flow devices with low dissipation, but high contact area, are of importance in many applications. A well-known strategy to design such devices is multi-scale topology optimization (MTO), where optimal microstructures are designed within each cell of a discretized domain. Unfortunately, MTO is computationally very expensive since one must perform homogenization of the evolving microstructures, during each step of the homogenization process. As an alternate, we propose here a graded multiscale topology optimization (GMTO) for designing fluid-flow devices. In the proposed method, several pre-selected but size-parameterized and orientable microstructures are used to fill the domain optimally. GMTO significantly reduces the computation while retaining many of the benefits of MTO. In particular, GMTO is implemented here using a neural-network (NN) since: (1) homogenization can be performed off-line, and used by the NN during optimization, (2) it enables continuous switching between microstructures during optimization, (3) the number of design variables and computational effort is independent of number of microstructure used, and, (4) it supports automatic differentiation, thereby eliminating manual sensitivity analysis. Several numerical results are presented to illustrate the proposed framework.

Remotely sensed geospatial data are critical for applications including precision agriculture, urban planning, disaster monitoring and response, and climate change research, among others. Deep learning methods are particularly promising for modeling many remote sensing tasks given the success of deep neural networks in similar computer vision tasks and the sheer volume of remotely sensed imagery available. However, the variance in data collection methods and handling of geospatial metadata make the application of deep learning methodology to remotely sensed data nontrivial. For example, satellite imagery often includes additional spectral bands beyond red, green, and blue and must be joined to other geospatial data sources that can have differing coordinate systems, bounds, and resolutions. To help realize the potential of deep learning for remote sensing applications, we introduce TorchGeo, a Python library for integrating geospatial data into the PyTorch deep learning ecosystem. TorchGeo provides data loaders for a variety of benchmark datasets, composable datasets for generic geospatial data sources, samplers for geospatial data, and transforms that work with multispectral imagery. TorchGeo is also the first library to provide pre-trained models for multispectral satellite imagery (e.g., models that use all bands from the Sentinel-2 satellites), allowing for advances in transfer learning on downstream remote sensing tasks with limited labeled data. We use TorchGeo to create reproducible benchmark results on existing datasets and benchmark our proposed method for preprocessing geospatial imagery on the fly. TorchGeo is open source and available on GitHub: https://github.com/microsoft/torchgeo.

In this paper, we study the problem of PAC learning halfspaces in the non-interactive local differential privacy model (NLDP). To breach the barrier of exponential sample complexity, previous results studied a relaxed setting where the server has access to some additional public but unlabeled data. We continue in this direction. Specifically, we consider the problem under the standard setting instead of the large margin setting studied before. Under different mild assumptions on the underlying data distribution, we propose two approaches that are based on the Massart noise model and self-supervised learning and show that it is possible to achieve sample complexities that are only linear in the dimension and polynomial in other terms for both private and public data, which significantly improve the previous results. Our methods could also be used for other private PAC learning problems.

The past decade has witnessed transformative applications of deep learning in various computational imaging, sensing and microscopy tasks. Due to the supervised learning schemes employed, most of these methods depend on large-scale, diverse, and labeled training data. The acquisition and preparation of such training image datasets are often laborious and costly, also leading to biased estimation and limited generalization to new types of samples. Here, we report a self-supervised learning model, termed GedankenNet, that eliminates the need for labeled or experimental training data, and demonstrate its effectiveness and superior generalization on hologram reconstruction tasks. Without prior knowledge about the sample types to be imaged, the self-supervised learning model was trained using a physics-consistency loss and artificial random images that are synthetically generated without any experiments or resemblance to real-world samples. After its self-supervised training, GedankenNet successfully generalized to experimental holograms of various unseen biological samples, reconstructing the phase and amplitude images of different types of objects using experimentally acquired test holograms. Without access to experimental data or the knowledge of real samples of interest or their spatial features, GedankenNet's self-supervised learning achieved complex-valued image reconstructions that are consistent with the Maxwell's equations, meaning that its output inference and object solutions accurately represent the wave propagation in free-space. This self-supervised learning of image reconstruction tasks opens up new opportunities for various inverse problems in holography, microscopy and computational imaging fields.

Graph-level representation learning is the pivotal step for downstream tasks that operate on the whole graph. The most common approach to this problem heretofore is graph pooling, where node features are typically averaged or summed to obtain the graph representations. However, pooling operations like averaging or summing inevitably cause massive information missing, which may severely downgrade the final performance. In this paper, we argue what is crucial to graph-level downstream tasks includes not only the topological structure but also the distribution from which nodes are sampled. Therefore, powered by existing Graph Neural Networks (GNN), we propose a new plug-and-play pooling module, termed as Distribution Knowledge Embedding (DKEPool), where graphs are rephrased as distributions on top of GNNs and the pooling goal is to summarize the entire distribution information instead of retaining a certain feature vector by simple predefined pooling operations. A DKEPool network de facto disassembles representation learning into two stages, structure learning and distribution learning. Structure learning follows a recursive neighborhood aggregation scheme to update node features where structure information is obtained. Distribution learning, on the other hand, omits node interconnections and focuses more on the distribution depicted by all the nodes. Extensive experiments demonstrate that the proposed DKEPool significantly and consistently outperforms the state-of-the-art methods.

Photoactive iridium complexes are of broad interest due to their applications ranging from lighting to photocatalysis. However, the excited state property prediction of these complexes challenges ab initio methods such as time-dependent density functional theory (TDDFT) both from an accuracy and a computational cost perspective, complicating high throughput virtual screening (HTVS). We instead leverage low-cost machine learning (ML) models to predict the excited state properties of photoactive iridium complexes. We use experimental data of 1,380 iridium complexes to train and evaluate the ML models and identify the best-performing and most transferable models to be those trained on electronic structure features from low-cost density functional theory tight binding calculations. Using these models, we predict the three excited state properties considered, mean emission energy of phosphorescence, excited state lifetime, and emission spectral integral, with accuracy competitive with or superseding TDDFT. We conduct feature importance analysis to identify which iridium complex attributes govern excited state properties and we validate these trends with explicit examples. As a demonstration of how our ML models can be used for HTVS and the acceleration of chemical discovery, we curate a set of novel hypothetical iridium complexes and identify promising ligands for the design of new phosphors.

This paper proposes a novel scoring function for the planning module of MPC-based model-based reinforcement learning methods to address the inherent bias of using the reward function to score trajectories. The proposed method enhances the learning efficiency of existing MPC-based MBRL methods using the discounted sum of values. The method utilizes optimal trajectories to guide policy learning and updates its state-action value function based on real-world and augmented on-board data. The learning efficiency of the proposed method is evaluated in selected MuJoCo Gym environments as well as in learning locomotion skills for a simulated model of the Cassie robot. The results demonstrate that the proposed method outperforms the current state-of-the-art algorithms in terms of learning efficiency and average reward return.

Over a five-year period, computing methods for generating high-fidelity, fictional depictions of people and events moved from exotic demonstrations by computer science research teams into ongoing use as a tool of disinformation. The methods, referred to with the portmanteau of "deepfakes," have been used to create compelling audiovisual content. Here, I share challenges ahead with malevolent uses of two classes of deepfakes that we can expect to come into practice with costly implications for society: interactive and compositional deepfakes. Interactive deepfakes have the capability to impersonate people with realistic interactive behaviors, taking advantage of advances in multimodal interaction. Compositional deepfakes leverage synthetic content in larger disinformation plans that integrate sets of deepfakes over time with observed, expected, and engineered world events to create persuasive synthetic histories. Synthetic histories can be constructed manually but may one day be guided by adversarial generative explanation (AGE) techniques. In the absence of mitigations, interactive and compositional deepfakes threaten to move us closer to a post-epistemic world, where fact cannot be distinguished from fiction. I shall describe interactive and compositional deepfakes and reflect about cautions and potential mitigations to defend against them.

Most Graph Neural Networks (GNNs) cannot distinguish some graphs or indeed some pairs of nodes within a graph. This makes it impossible to solve certain classification tasks. However, adding additional node features to these models can resolve this problem. We introduce several such augmentations, including (i) positional node embeddings, (ii) canonical node IDs, and (iii) random features. These extensions are motivated by theoretical results and corroborated by extensive testing on synthetic subgraph detection tasks. We find that positional embeddings significantly outperform other extensions in these tasks. Moreover, positional embeddings have better sample efficiency, perform well on different graph distributions and even outperform learning with ground truth node positions. Finally, we show that the different augmentations perform competitively on established GNN benchmarks, and advise on when to use them.

Though deep reinforcement learning (DRL) has obtained substantial success, it may encounter catastrophic failures due to the intrinsic uncertainty of both transition and observation. Most of the existing methods for safe reinforcement learning can only handle transition disturbance or observation disturbance since these two kinds of disturbance affect different parts of the agent; besides, the popular worst-case return may lead to overly pessimistic policies. To address these issues, we first theoretically prove that the performance degradation under transition disturbance and observation disturbance depends on a novel metric of Value Function Range (VFR), which corresponds to the gap in the value function between the best state and the worst state. Based on the analysis, we adopt conditional value-at-risk (CVaR) as an assessment of risk and propose a novel reinforcement learning algorithm of CVaR-Proximal-Policy-Optimization (CPPO) which formalizes the risk-sensitive constrained optimization problem by keeping its CVaR under a given threshold. Experimental results show that CPPO achieves a higher cumulative reward and is more robust against both observation and transition disturbances on a series of continuous control tasks in MuJoCo.

This paper addresses two major challenges in terahertz (THz) channel estimation: the beam-split phenomenon, i.e., beam misalignment because of frequency-independent analog beamformers, and computational complexity because of the usage of ultra-massive number of antennas to compensate propagation losses. Data-driven techniques are known to mitigate the complexity of this problem but usually require the transmission of the datasets from the users to a central server entailing huge communication overhead. In this work, we employ federated learning (FL), wherein the users transmit only the model parameters instead of the whole dataset, for THz channel estimation to improve the communications-efficiency. In order to accurately estimate the channel despite beam-split, we propose a beamspace support alignment (BSA) technique. By exploiting the sparsity of the THz channel, the proposed approach is implemented with fewer pilot signals than the traditional techniques. Compared to the previous works, our FL-BSA approach provides higher channel estimation accuracy as well as approximately 68 (32) times lower model (channel) training overhead, respectively.

Upper limb movement classification, which maps input signals to the target activities, is a key building block in the control of rehabilitative robotics. Classifiers are trained for the rehabilitative system to comprehend the desires of the patient whose upper limbs do not function properly. Electromyography (EMG) signals and Electroencephalography (EEG) signals are used widely for upper limb movement classification. By analysing the classification results of the real-time EEG and EMG signals, the system can understand the intention of the user and predict the events that one would like to carry out. Accordingly, it will provide external help to the user. However, the noise in the real-time EEG and EMG data collection process contaminates the effectiveness of the data, which undermines classification performance. Moreover, not all patients process strong EMG signals due to muscle damage and neuromuscular disorder. To address these issues, this paper explores different feature extraction techniques and machine learning and deep learning models for EEG and EMG signals classification and proposes a novel decision-level multisensor fusion technique to integrate EEG signals with EMG signals. This system retrieves effective information from both sources to understand and predict the desire of the user, and thus aid. By testing out the proposed technique on a publicly available WAY-EEG-GAL dataset, which contains EEG and EMG signals that were recorded simultaneously, we manage to conclude the feasibility and effectiveness of the novel system.

Over-parameterized models, typically pretrained language models (LMs), have shown an appealing expressive power due to their small learning bias. However, the huge learning capacity of LMs can also lead to large learning variance. In a pilot study, we find that, when faced with multiple domains, a critical portion of parameters behave unexpectedly in a domain-specific manner while others behave in a domain-general one. Motivated by this phenomenon, we for the first time posit that domain-general parameters can underpin a domain-general LM that can be derived from the original LM. To uncover the domain-general LM, we propose to identify domain-general parameters by playing lottery tickets (dubbed doge tickets). In order to intervene the lottery, we propose a domain-general score, which depicts how domain-invariant a parameter is by associating it with the variance. Comprehensive experiments are conducted on the Amazon, Mnli and OntoNotes datasets. The results show that the doge tickets obtains an improved out-of-domain generalization in comparison with a range of competitive baselines. Analysis results further hint the existence of domain-general parameters and the performance consistency of doge tickets.

Subgraph GNNs are a recent class of expressive Graph Neural Networks (GNNs) which model graphs as collections of subgraphs. So far, the design space of possible Subgraph GNN architectures as well as their basic theoretical properties are still largely unexplored. In this paper, we study the most prominent form of subgraph methods, which employs node-based subgraph selection policies such as ego-networks or node marking and deletion. We address two central questions: (1) What is the upper-bound of the expressive power of these methods? and (2) What is the family of equivariant message passing layers on these sets of subgraphs?. Our first step in answering these questions is a novel symmetry analysis which shows that modelling the symmetries of node-based subgraph collections requires a significantly smaller symmetry group than the one adopted in previous works. This analysis is then used to establish a link between Subgraph GNNs and Invariant Graph Networks (IGNs). We answer the questions above by first bounding the expressive power of subgraph methods by 3-WL, and then proposing a general family of message-passing layers for subgraph methods that generalises all previous node-based Subgraph GNNs. Finally, we design a novel Subgraph GNN dubbed SUN, which theoretically unifies previous architectures while providing better empirical performance on multiple benchmarks.

Implicit feedback is frequently used for developing personalized recommendation services due to its ubiquity and accessibility in real-world systems. In order to effectively utilize such information, most research adopts the pairwise ranking method on constructed training triplets (user, positive item, negative item) and aims to distinguish between positive items and negative items for each user. However, most of these methods treat all the training triplets equally, which ignores the subtle difference between different positive or negative items. On the other hand, even though some other works make use of the auxiliary information (e.g., dwell time) of user behaviors to capture this subtle difference, such auxiliary information is hard to obtain. To mitigate the aforementioned problems, we propose a novel training framework named Triplet Importance Learning (TIL), which adaptively learns the importance score of training triplets. We devise two strategies for the importance score generation and formulate the whole procedure as a bilevel optimization, which does not require any rule-based design. We integrate the proposed training procedure with several Matrix Factorization (MF)- and Graph Neural Network (GNN)-based recommendation models, demonstrating the compatibility of our framework. Via a comparison using three real-world datasets with many state-of-the-art methods, we show that our proposed method outperforms the best existing models by 3-21\% in terms of Recall@k for the top-k recommendation.

Natural language is one of the most intuitive ways to express human intent. However, translating instructions and commands towards robotic motion generation and deployment in the real world is far from being an easy task. The challenge of combining a robot's inherent low-level geometric and kinodynamic constraints with a human's high-level semantic instructions traditionally is solved using task-specific solutions with little generalizability between hardware platforms, often with the use of static sets of target actions and commands. This work instead proposes a flexible language-based framework that allows a user to modify generic robotic trajectories. Our method leverages pre-trained language models (BERT and CLIP) to encode the user's intent and target objects directly from a free-form text input and scene images, fuses geometrical features generated by a transformer encoder network, and finally outputs trajectories using a transformer decoder, without the need of priors related to the task or robot information. We significantly extend our own previous work presented in Bucker et al. by expanding the trajectory parametrization space to 3D and velocity as opposed to just XY movements. In addition, we now train the model to use actual images of the objects in the scene for context (as opposed to textual descriptions), and we evaluate the system in a diverse set of scenarios beyond manipulation, such as aerial and legged robots. Our simulated and real-life experiments demonstrate that our transformer model can successfully follow human intent, modifying the shape and speed of trajectories within multiple environments. Codebase available at: https://github.com/arthurfenderbucker/LaTTe-Language-Trajectory-TransformEr.git

Most real-world problems that machine learning algorithms are expected to solve face the situation with 1) unknown data distribution; 2) little domain-specific knowledge; and 3) datasets with limited annotation. We propose Non-Parametric learning by Compression with Latent Variables (NPC-LV), a learning framework for any dataset with abundant unlabeled data but very few labeled ones. By only training a generative model in an unsupervised way, the framework utilizes the data distribution to build a compressor. Using a compressor-based distance metric derived from Kolmogorov complexity, together with few labeled data, NPC-LV classifies without further training. We show that NPC-LV outperforms supervised methods on all three datasets on image classification in low data regime and even outperform semi-supervised learning methods on CIFAR-10. We demonstrate how and when negative evidence lowerbound (nELBO) can be used as an approximate compressed length for classification. By revealing the correlation between compression rate and classification accuracy, we illustrate that under NPC-LV, the improvement of generative models can enhance downstream classification accuracy.

We introduce the Block-Recurrent Transformer, which applies a transformer layer in a recurrent fashion along a sequence, and has linear complexity with respect to sequence length. Our recurrent cell operates on blocks of tokens rather than single tokens during training, and leverages parallel computation within a block in order to make efficient use of accelerator hardware. The cell itself is strikingly simple. It is merely a transformer layer: it uses self-attention and cross-attention to efficiently compute a recurrent function over a large set of state vectors and tokens. Our design was inspired in part by LSTM cells, and it uses LSTM-style gates, but it scales the typical LSTM cell up by several orders of magnitude. Our implementation of recurrence has the same cost in both computation time and parameter count as a conventional transformer layer, but offers dramatically improved perplexity in language modeling tasks over very long sequences. Our model out-performs a long-range Transformer XL baseline by a wide margin, while running twice as fast. We demonstrate its effectiveness on PG19 (books), arXiv papers, and GitHub source code. Our code has been released as open source.

We study the problem of safe and intention-aware robot navigation in dense and interactive crowds. Most previous reinforcement learning (RL) based methods fail to consider different types of interactions among all agents or ignore the intentions of people, which results in performance degradation. In this paper, we propose a novel recurrent graph neural network with attention mechanisms to capture heterogeneous interactions among agents through space and time. To encourage longsighted robot behaviors, we infer the intentions of dynamic agents by predicting their future trajectories for several timesteps. The predictions are incorporated into a model-free RL framework to prevent the robot from intruding into the intended paths of other agents. We demonstrate that our method enables the robot to achieve good navigation performance and non-invasiveness in challenging crowd navigation scenarios. We successfully transfer the policy learned in simulation to a real-world TurtleBot 2i.

We are now witnessing significant progress of deep learning methods in a variety of tasks (or datasets) of proteins. However, there is a lack of a standard benchmark to evaluate the performance of different methods, which hinders the progress of deep learning in this field. In this paper, we propose such a benchmark called PEER, a comprehensive and multi-task benchmark for Protein sEquence undERstanding. PEER provides a set of diverse protein understanding tasks including protein function prediction, protein localization prediction, protein structure prediction, protein-protein interaction prediction, and protein-ligand interaction prediction. We evaluate different types of sequence-based methods for each task including traditional feature engineering approaches, different sequence encoding methods as well as large-scale pre-trained protein language models. In addition, we also investigate the performance of these methods under the multi-task learning setting. Experimental results show that large-scale pre-trained protein language models achieve the best performance for most individual tasks, and jointly training multiple tasks further boosts the performance. The datasets and source codes of this benchmark are all available at https://github.com/DeepGraphLearning/PEER_Benchmark

Numbers are essential components of text, like any other word tokens, from which natural language processing (NLP) models are built and deployed. Though numbers are typically not accounted for distinctly in most NLP tasks, there is still an underlying amount of numeracy already exhibited by NLP models. In this work, we attempt to tap this potential of state-of-the-art NLP models and transfer their ability to boost performance in related tasks. Our proposed classification of numbers into entities helps NLP models perform well on several tasks, including a handcrafted Fill-In-The-Blank (FITB) task and on question answering using joint embeddings, outperforming the BERT and RoBERTa baseline classification.

High-quality medical systematic reviews require comprehensive literature searches to ensure the recommendations and outcomes are sufficiently reliable. Indeed, searching for relevant medical literature is a key phase in constructing systematic reviews and often involves domain (medical researchers) and search (information specialists) experts in developing the search queries. Queries in this context are highly complex, based on Boolean logic, include free-text terms and index terms from standardised terminologies (e.g., the Medical Subject Headings (MeSH) thesaurus), and are difficult and time-consuming to build. The use of MeSH terms, in particular, has been shown to improve the quality of the search results. However, identifying the correct MeSH terms to include in a query is difficult: information experts are often unfamiliar with the MeSH database and unsure about the appropriateness of MeSH terms for a query. Naturally, the full value of the MeSH terminology is often not fully exploited. This article investigates methods to suggest MeSH terms based on an initial Boolean query that includes only free-text terms. In this context, we devise lexical and pre-trained language models based methods. These methods promise to automatically identify highly effective MeSH terms for inclusion in a systematic review query. Our study contributes an empirical evaluation of several MeSH term suggestion methods. We further contribute an extensive analysis of MeSH term suggestions for each method and how these suggestions impact the effectiveness of Boolean queries.

Weather Forecasting is an attractive challengeable task due to its influence on human life and complexity in atmospheric motion. Supported by massive historical observed time series data, the task is suitable for data-driven approaches, especially deep neural networks. Recently, the Graph Neural Networks (GNNs) based methods have achieved excellent performance for spatio-temporal forecasting. However, the canonical GNNs-based methods only individually model the local graph of meteorological variables per station or the global graph of whole stations, lacking information interaction between meteorological variables in different stations. In this paper, we propose a novel Hierarchical Spatio-Temporal Graph Neural Network (HiSTGNN) to model cross-regional spatio-temporal correlations among meteorological variables in multiple stations. An adaptive graph learning layer and spatial graph convolution are employed to construct self-learning graph and study hidden dependency among nodes of variable-level and station-level graph. For capturing temporal pattern, the dilated inception as the backbone of gate temporal convolution is designed to model long and various meteorological trends. Moreover, a dynamic interaction learning is proposed to build bidirectional information passing in hierarchical graph. Experimental results on three real-world meteorological datasets demonstrate the superior performance of HiSTGNN beyond 7 baselines and it reduces the errors by 4.2% to 11.6% especially compared to state-of-the-art weather forecasting method.

Purpose: We perform anatomical landmarking for craniomaxillofacial (CMF) bones without explicitly segmenting them. Towards this, we propose a new simple yet efficient deep network architecture, called \textit{relational reasoning network (RRN)}, to accurately learn the local and the global relations among the landmarks in CMF bones; specifically, mandible, maxilla, and nasal bones. Approach: The proposed RRN works in an end-to-end manner, utilizing learned relations of the landmarks based on dense-block units. For a given few landmarks as input, RRN treats the landmarking process similar to a data imputation problem where predicted landmarks are considered missing. Results: We applied RRN to cone beam computed tomography scans obtained from 250 patients. With a 4-fold cross validation technique, we obtained an average root mean squared error of less than 2 mm per landmark. Our proposed RRN has revealed unique relationships among the landmarks that help us in inferring several \textit{reasoning} about informativeness of the landmark points. The proposed system identifies the missing landmark locations accurately even when severe pathology or deformation are present in the bones. Conclusions: Accurately identifying anatomical landmarks is a crucial step in deformation analysis and surgical planning for CMF surgeries. Achieving this goal without the need for explicit bone segmentation addresses a major limitation of segmentation based approaches, where segmentation failure (as often the case in bones with severe pathology or deformation) could easily lead to incorrect landmarking. To the best of our knowledge, this is the first of its kind algorithm finding anatomical relations of the objects using deep learning.

With the advancement of deep learning techniques, an increasing number of methods have been proposed for optic disc and cup (OD/OC) segmentation from the fundus images. Clinically, OD/OC segmentation is often annotated by multiple clinical experts to mitigate the personal bias. However, it is hard to train the automated deep learning models on multiple labels. A common practice to tackle the issue is majority vote, e.g., taking the average of multiple labels. However such a strategy ignores the different expertness of medical experts. Motivated by the observation that OD/OC segmentation is often used for the glaucoma diagnosis clinically, in this paper, we propose a novel strategy to fuse the multi-rater OD/OC segmentation labels via the glaucoma diagnosis performance. Specifically, we assess the expertness of each rater through an attentive glaucoma diagnosis network. For each rater, its contribution for the diagnosis will be reflected as an expertness map. To ensure the expertness maps are general for different glaucoma diagnosis models, we further propose an Expertness Generator (ExpG) to eliminate the high-frequency components in the optimization process. Based on the obtained expertness maps, the multi-rater labels can be fused as a single ground-truth which we dubbed as Diagnosis First Ground-truth (DiagFirstGT). Experimental results show that by using DiagFirstGT as ground-truth, OD/OC segmentation networks will predict the masks with superior glaucoma diagnosis performance.

Machine unlearning is a process of removing the impact of some training data from the machine learning (ML) models upon receiving removal requests. While straightforward and legitimate, retraining the ML model from scratch incurs a high computational overhead. To address this issue, a number of approximate algorithms have been proposed in the domain of image and text data, among which SISA is the state-of-the-art solution. It randomly partitions the training set into multiple shards and trains a constituent model for each shard. However, directly applying SISA to the graph data can severely damage the graph structural information, and thereby the resulting ML model utility. In this paper, we propose GraphEraser, a novel machine unlearning framework tailored to graph data. Its contributions include two novel graph partition algorithms and a learning-based aggregation method. We conduct extensive experiments on five real-world graph datasets to illustrate the unlearning efficiency and model utility of GraphEraser. It achieves 2.06$\times$ (small dataset) to 35.94$\times$ (large dataset) unlearning time improvement. On the other hand, GraphEraser achieves up to $62.5\%$ higher F1 score and our proposed learning-based aggregation method achieves up to $112\%$ higher F1 score.\footnote{Our code is available at \url{https://github.com/MinChen00/Graph-Unlearning}.}

There are many contexts in which dyadic data are present. Social networks are a well-known example. In these contexts, pairs of elements are linked building a network that reflects interactions. Explaining why these relationships are established is essential to obtain transparency, an increasingly important notion. These explanations are often presented using text, thanks to the spread of the natural language understanding tasks. Our aim is to represent and explain pairs established by any agent (e.g., a recommender system or a paid promotion mechanism), so that text-based personalisation is taken into account. We have focused on the TripAdvisor platform, considering the applicability to other dyadic data contexts. The items are a subset of users and restaurants and the interactions the reviews posted by these users. We propose the PTER (Personalised TExt-based Reviews) model. We predict, from the available reviews for a given restaurant, those that fit to the specific user interactions. PTER leverages the BERT (Bidirectional Encoders Representations from Transformers) transformer-encoder model. We customised a deep neural network following the feature-based approach, presenting a LTR (Learning To Rank) downstream task. We carried out several comparisons of our proposal with a random baseline and other models of the state of the art, following the EXTRA (EXplanaTion RAnking) benchmark. Our method outperforms other collaborative filtering proposals.

The staple of human intelligence is the capability of acquiring knowledge in a continuous fashion. In stark contrast, Deep Networks forget catastrophically and, for this reason, the sub-field of Class-Incremental Continual Learning fosters methods that learn a sequence of tasks incrementally, blending sequentially-gained knowledge into a comprehensive prediction. This work aims at assessing and overcoming the pitfalls of our previous proposal Dark Experience Replay (DER), a simple and effective approach that combines rehearsal and Knowledge Distillation. Inspired by the way our minds constantly rewrite past recollections and set expectations for the future, we endow our model with the abilities to i) revise its replay memory to welcome novel information regarding past data ii) pave the way for learning yet unseen classes. We show that the application of these strategies leads to remarkable improvements; indeed, the resulting method - termed eXtended-DER (X-DER) - outperforms the state of the art on both standard benchmarks (such as CIFAR-100 and miniImagenet) and a novel one here introduced. To gain a better understanding, we further provide extensive ablation studies that corroborate and extend the findings of our previous research (e.g. the value of Knowledge Distillation and flatter minima in continual learning setups).

This paper presents the HiPart package, an open-source native python library that provides efficient and interpret-able implementations of divisive hierarchical clustering algorithms. HiPart supports interactive visualizations for the manipulation of the execution steps allowing the direct intervention of the clustering outcome. This package is highly suited for Big Data applications as the focus has been given to the computational efficiency of the implemented clustering methodologies. The dependencies used are either Python build-in packages or highly maintained stable external packages. The software is provided under the MIT license. The package's source code and documentation can be found at https://github.com/panagiotisanagnostou/HiPart.

Within the mathematical finance literature there is a rich catalogue of mathematical models for studying algorithmic trading problems -- such as market-making and optimal execution -- in limit order books. This paper introduces \mbtgym, a Python module that provides a suite of gym environments for training reinforcement learning (RL) agents to solve such model-based trading problems. The module is set up in an extensible way to allow the combination of different aspects of different models. It supports highly efficient implementations of vectorized environments to allow faster training of RL agents. In this paper, we motivate the challenge of using RL to solve such model-based limit order book problems in mathematical finance, we explain the design of our gym environment, and then demonstrate its use in solving standard and non-standard problems from the literature. Finally, we lay out a roadmap for further development of our module, which we provide as an open source repository on GitHub so that it can serve as a focal point for RL research in model-based algorithmic trading.

Given a long list of anomaly detection algorithms developed in the last few decades, how do they perform with regard to (i) varying levels of supervision, (ii) different types of anomalies, and (iii) noisy and corrupted data? In this work, we answer these key questions by conducting (to our best knowledge) the most comprehensive anomaly detection benchmark with 30 algorithms on 57 benchmark datasets, named ADBench. Our extensive experiments (98,436 in total) identify meaningful insights into the role of supervision and anomaly types, and unlock future directions for researchers in algorithm selection and design. With ADBench, researchers can easily conduct comprehensive and fair evaluations for newly proposed methods on the datasets (including our contributed ones from natural language and computer vision domains) against the existing baselines. To foster accessibility and reproducibility, we fully open-source ADBench and the corresponding results.

We develop a modified online mirror descent framework that is suitable for building adaptive and parameter-free algorithms in unbounded domains. We leverage this technique to develop the first unconstrained online linear optimization algorithm achieving an optimal dynamic regret bound, and we further demonstrate that natural strategies based on Follow-the-Regularized-Leader are unable to achieve similar results. We also apply our mirror descent framework to build new parameter-free implicit updates, as well as a simplified and improved unconstrained scale-free algorithm.

Optical coherence tomography (OCT) imaging from different camera devices causes challenging domain shifts and can cause a severe drop in accuracy for machine learning models. In this work, we introduce a minimal noise adaptation method based on a singular value decomposition (SVDNA) to overcome the domain gap between target domains from three different device manufacturers in retinal OCT imaging. Our method utilizes the difference in noise structure to successfully bridge the domain gap between different OCT devices and transfer the style from unlabeled target domain images to source images for which manual annotations are available. We demonstrate how this method, despite its simplicity, compares or even outperforms state-of-the-art unsupervised domain adaptation methods for semantic segmentation on a public OCT dataset. SVDNA can be integrated with just a few lines of code into the augmentation pipeline of any network which is in contrast to many state-of-the-art domain adaptation methods which often need to change the underlying model architecture or train a separate style transfer model. The full code implementation for SVDNA is available at https://github.com/ValentinKoch/SVDNA.

We introduce a simple and intuitive framework that provides quantitative explanations of statistical models through the probabilistic assessment of input feature importance. The core idea comes from utilizing the Dirichlet distribution to define the importance of input features and learning it via approximate Bayesian inference. The learned importance has probabilistic interpretation and provides the relative significance of each input feature to a model's output, additionally assessing confidence about its importance quantification. As a consequence of using the Dirichlet distribution over the explanations, we can define a closed-form divergence to gauge the similarity between learned importance under different models. We use this divergence to study the feature importance explainability tradeoffs with essential notions in modern machine learning, such as privacy and fairness. Furthermore, BIF can work on two levels: global explanation (feature importance across all data instances) and local explanation (individual feature importance for each data instance). We show the effectiveness of our method on a variety of synthetic and real datasets, taking into account both tabular and image datasets. The code is available at https://github.com/kamadforge/featimp_dp.

Ventricular tachycardia (VT) can be one cause of sudden cardiac death affecting 4.25 million persons per year worldwide. A curative treatment is catheter ablation in order to inactivate the abnormally triggering regions. To facilitate and expedite the localization during the ablation procedure, we present two novel localization techniques based on convolutional neural networks (CNNs). In contrast to existing methods, e.g. using ECG imaging, our approaches were designed to be independent of the patient-specific geometries and directly applicable to surface ECG signals, while also delivering a binary transmural position. One method outputs ranked alternative solutions. Results can be visualized either on a generic or patient geometry. The CNNs were trained on a data set containing only simulated data and evaluated both on simulated and clinical test data. On simulated data, the median test error was below 3mm. The median localization error on the clinical data was as low as 32mm. The transmural position was correctly detected in up to 82% of all clinical cases. Using the ranked alternative solutions, the top-3 median error dropped to 20mm on clinical data. These results demonstrate a proof of principle to utilize CNNs to localize the activation source without the intrinsic need of patient-specific geometrical information. Furthermore, delivering multiple solutions can help the physician to find the real activation source amongst more than one possible locations. With further optimization, these methods have a high potential to speed up clinical interventions. Consequently they could decrease procedural risk and improve VT patients' outcomes.

Networks are ubiquitous in many real-world applications (e.g., social networks encoding trust/distrust relationships, correlation networks arising from time series data). While many networks are signed or directed, or both, there is a lack of unified software packages on graph neural networks (GNNs) specially designed for signed and directed networks. In this paper, we present PyTorch Geometric Signed Directed, a software package which fills this gap. Along the way, we also provide a brief review surveying typical tasks, loss functions and evaluation metrics in the analysis of signed and directed networks, discuss data used in related experiments, provide an overview of methods proposed, and evaluate the implemented methods with experiments. The deep learning framework consists of easy-to-use GNN models, synthetic and real-world data, as well as task-specific evaluation metrics and loss functions for signed and directed networks. As an extension library for PyTorch Geometric, our proposed software is maintained with open-source releases, detailed documentation, continuous integration, unit tests and code coverage checks. Our code is publicly available at \url{https://github.com/SherylHYX/pytorch_geometric_signed_directed}.

We present a new technique for the accelerated training of physics-informed neural networks (PINNs): discretely-trained PINNs (DT-PINNs). The repeated computation of partial derivative terms in the PINN loss functions via automatic differentiation during training is known to be computationally expensive, especially for higher-order derivatives. DT-PINNs are trained by replacing these exact spatial derivatives with high-order accurate numerical discretizations computed using meshless radial basis function-finite differences (RBF-FD) and applied via sparse-matrix vector multiplication. The use of RBF-FD allows for DT-PINNs to be trained even on point cloud samples placed on irregular domain geometries. Additionally, though traditional PINNs (vanilla-PINNs) are typically stored and trained in 32-bit floating-point (fp32) on the GPU, we show that for DT-PINNs, using fp64 on the GPU leads to significantly faster training times than fp32 vanilla-PINNs with comparable accuracy. We demonstrate the efficiency and accuracy of DT-PINNs via a series of experiments. First, we explore the effect of network depth on both numerical and automatic differentiation of a neural network with random weights and show that RBF-FD approximations of third-order accuracy and above are more efficient while being sufficiently accurate. We then compare the DT-PINNs to vanilla-PINNs on both linear and nonlinear Poisson equations and show that DT-PINNs achieve similar losses with 2-4x faster training times on a consumer GPU. Finally, we also demonstrate that similar results can be obtained for the PINN solution to the heat equation (a space-time problem) by discretizing the spatial derivatives using RBF-FD and using automatic differentiation for the temporal derivative. Our results show that fp64 DT-PINNs offer a superior cost-accuracy profile to fp32 vanilla-PINNs.

In this paper, we study the statistical limits in terms of Sobolev norms of gradient descent for solving inverse problem from randomly sampled noisy observations using a general class of objective functions. Our class of objective functions includes Sobolev training for kernel regression, Deep Ritz Methods (DRM), and Physics Informed Neural Networks (PINN) for solving elliptic partial differential equations (PDEs) as special cases. We consider a potentially infinite-dimensional parameterization of our model using a suitable Reproducing Kernel Hilbert Space and a continuous parameterization of problem hardness through the definition of kernel integral operators. We prove that gradient descent over this objective function can also achieve statistical optimality and the optimal number of passes over the data increases with sample size. Based on our theory, we explain an implicit acceleration of using a Sobolev norm as the objective function for training, inferring that the optimal number of epochs of DRM becomes larger than the number of PINN when both the data size and the hardness of tasks increase, although both DRM and PINN can achieve statistical optimality.

Reinforcement learning (RL) techniques have been developed to optimize industrial cooling systems, offering substantial energy savings compared to traditional heuristic policies. A major challenge in industrial control involves learning behaviors that are feasible in the real world due to machinery constraints. For example, certain actions can only be executed every few hours while other actions can be taken more frequently. Without extensive reward engineering and experimentation, an RL agent may not learn realistic operation of machinery. To address this, we use hierarchical reinforcement learning with multiple agents that control subsets of actions according to their operation time scales. Our hierarchical approach achieves energy savings over existing baselines while maintaining constraints such as operating chillers within safe bounds in a simulated HVAC control environment.

Parameter learning for high-dimensional, partially observed, and nonlinear stochastic processes is a methodological challenge. Spatiotemporal disease transmission systems provide examples of such processes giving rise to open inference problems. We propose the iterated block particle filter (IBPF) algorithm for learning high-dimensional parameters over graphical state space models with general state spaces, measures, transition densities and graph structure. Theoretical performance guarantees are obtained on beating the curse of dimensionality (COD), algorithm convergence, and likelihood maximization. Experiments on a highly nonlinear and non-Gaussian spatiotemporal model for measles transmission reveal that the iterated ensemble Kalman filter algorithm (Li et al. (2020)) is ineffective and the iterated filtering algorithm (Ionides et al. (2015)) suffers from the COD, while our IBPF algorithm beats COD consistently across various experiments with different metrics.

In modern highly interconnected power grids, automatic generation control (AGC) is crucial in maintaining the stability of the power grid. The dependence of the AGC system on the information and communications technology (ICT) system makes it vulnerable to various types of cyber-attacks. Thus, information flow (IF) analysis and anomaly detection became paramount for preventing cyber attackers from driving the cyber-physical power system (CPPS) to instability. In this paper, the ICT network traffic rules in CPPSs are explored and the frequency domain features of the ICT network traffic are extracted, basically for developing a robust learning algorithm that can learn the normal traffic pattern based on the ResNeSt convolutional neural network (CNN). Furthermore, to overcome the problem of insufficient abnormal traffic labeled samples, transfer learning approach is used. In the proposed data-driven-based method the deep learning model is trained by traffic frequency features, which makes our model robust against AGC's parameters uncertainties and modeling nonlinearities.

Power systems are prone to a variety of events (e.g. line trips and generation loss) and real-time identification of such events is crucial in terms of situational awareness, reliability, and security. Using measurements from multiple synchrophasors, i.e., phasor measurement units (PMUs), we propose to identify events by extracting features based on modal dynamics. We combine such traditional physics-based feature extraction methods with machine learning to distinguish different event types. Including all measurement channels at each PMU allows exploiting diverse features but also requires learning classification models over a high-dimensional space. To address this issue, various feature selection methods are implemented to choose the best subset of features. Using the obtained subset of features, we investigate the performance of two well-known classification models, namely, logistic regression (LR) and support vector machines (SVM) to identify generation loss and line trip events in two datasets. The first dataset is obtained from simulated generation loss and line trip events in the Texas 2000-bus synthetic grid. The second is a proprietary dataset with labeled events obtained from a large utility in the USA involving measurements from nearly 500 PMUs. Our results indicate that the proposed framework is promising for identifying the two types of events.

Contemporary deep-learning object detection methods for autonomous driving usually assume prefixed categories of common traffic participants, such as pedestrians and cars. Most existing detectors are unable to detect uncommon objects and corner cases (e.g., a dog crossing a street), which may lead to severe accidents in some situations, making the timeline for the real-world application of reliable autonomous driving uncertain. One main reason that impedes the development of truly reliably self-driving systems is the lack of public datasets for evaluating the performance of object detectors on corner cases. Hence, we introduce a challenging dataset named CODA that exposes this critical problem of vision-based detectors. The dataset consists of 1500 carefully selected real-world driving scenes, each containing four object-level corner cases (on average), spanning more than 30 object categories. On CODA, the performance of standard object detectors trained on large-scale autonomous driving datasets significantly drops to no more than 12.8% in mAR. Moreover, we experiment with the state-of-the-art open-world object detector and find that it also fails to reliably identify the novel objects in CODA, suggesting that a robust perception system for autonomous driving is probably still far from reach. We expect our CODA dataset to facilitate further research in reliable detection for real-world autonomous driving. Our dataset will be released at https://coda-dataset.github.io.

Data is a key component of modern machine learning, but statistics for assessing data label quality remain sparse in literature. Here, we introduce DiPietro-Hazari Kappa, a novel statistical metric for assessing the quality of suggested dataset labels in the context of human annotation. Rooted in the classical Fleiss's Kappa measure of inter-annotator agreement, the DiPietro-Hazari Kappa quantifies the the empirical annotator agreement differential that was attained above random chance. We offer a thorough theoretical examination of Fleiss's Kappa before turning to our derivation of DiPietro-Hazari Kappa. Finally, we conclude with a matrix formulation and set of procedural instructions for easy computational implementation.

A protein performs biological functions by folding to a particular 3D structure. To accurately model the protein structures, both the overall geometric topology and local fine-grained relations between amino acids (e.g. side-chain torsion angles and inter-amino-acid orientations) should be carefully considered. In this work, we propose the Directed Weight Neural Network for better capturing geometric relations among different amino acids. Extending a single weight from a scalar to a 3D directed vector, our new framework supports a rich set of geometric operations on both classical and SO(3)--representation features, on top of which we construct a perceptron unit for processing amino-acid information. In addition, we introduce an equivariant message passing paradigm on proteins for plugging the directed weight perceptrons into existing Graph Neural Networks, showing superior versatility in maintaining SO(3)-equivariance at the global scale. Experiments show that our network has remarkably better expressiveness in representing geometric relations in comparison to classical neural networks and the (globally) equivariant networks. It also achieves state-of-the-art performance on various computational biology applications related to protein 3D structures.

The absorption, distribution, metabolism, excretion, and toxicity (ADMET) properties are important in drug discovery as they define efficacy and safety. In this work, we applied an ensemble of features, including fingerprints and descriptors, and a tree-based machine learning model, extreme gradient boosting, for accurate ADMET prediction. Our model performs well in the Therapeutics Data Commons ADMET benchmark group. For 22 tasks, our model is ranked first in 18 tasks and top 3 in 21 tasks. The trained machine learning models are integrated in ADMETboost, a web server that is publicly available at https://ai-druglab.smu.edu/admet.

Vision Transformers (ViTs) have triggered the most recent and significant breakthroughs in computer vision. Their efficient designs are mostly guided by the indirect metric of computational complexity, i.e., FLOPs, which however has a clear gap with the direct metric such as throughput. Thus, we propose to use the direct speed evaluation on the target platform as the design principle for efficient ViTs. Particularly, we introduce LITv2, a simple and effective ViT which performs favourably against the existing state-of-the-art methods across a spectrum of different model sizes with faster speed. At the core of LITv2 is a novel self-attention mechanism, which we dub HiLo. HiLo is inspired by the insight that high frequencies in an image capture local fine details and low frequencies focus on global structures, whereas a multi-head self-attention layer neglects the characteristic of different frequencies. Therefore, we propose to disentangle the high/low frequency patterns in an attention layer by separating the heads into two groups, where one group encodes high frequencies via self-attention within each local window, and another group performs the attention to model the global relationship between the average-pooled low-frequency keys from each window and each query position in the input feature map. Benefiting from the efficient design for both groups, we show that HiLo is superior to the existing attention mechanisms by comprehensively benchmarking FLOPs, speed and memory consumption on GPUs. Powered by HiLo, LITv2 serves as a strong backbone for mainstream vision tasks including image classification, dense detection and segmentation. Code is available at https://github.com/ziplab/LITv2.

Replay methods have shown to be successful in mitigating catastrophic forgetting in continual learning scenarios despite having limited access to historical data. However, storing historical data is cheap in many real-world applications, yet replaying all historical data would be prohibited due to processing time constraints. In such settings, we propose learning the time to learn for a continual learning system, in which we learn replay schedules over which tasks to replay at different time steps. To demonstrate the importance of learning the time to learn, we first use Monte Carlo tree search to find the proper replay schedule and show that it can outperform fixed scheduling policies in terms of continual learning performance. Moreover, to improve the scheduling efficiency itself, we propose to use reinforcement learning to learn the replay scheduling policies that can generalize to new continual learning scenarios without added computational cost. In our experiments, we show the advantages of learning the time to learn, which brings current continual learning research closer to real-world needs.

Decision trees are well-known due to their ease of interpretability. To improve accuracy, we need to grow deep trees or ensembles of trees. These are hard to interpret, offsetting their original benefits. Shapley values have recently become a popular way to explain the predictions of tree-based machine learning models. It provides a linear weighting to features independent of the tree structure. The rise in popularity is mainly due to TreeShap, which solves a general exponential complexity problem in polynomial time. Following extensive adoption in the industry, more efficient algorithms are required. This paper presents a more efficient and straightforward algorithm: Linear TreeShap. Like TreeShap, Linear TreeShap is exact and requires the same amount of memory.

To train deep learning models faster, distributed training on multiple GPUs is the very popular scheme in recent years. However, the communication bandwidth is still a major bottleneck of training performance. To improve overall training performance, recent works have proposed gradient sparsification methods that reduce the communication traffic significantly. Most of them require gradient sorting to select meaningful gradients such as Top-k gradient sparsification (Top-k SGD). However, Top-k SGD has a limit to increase the speed up overall training performance because gradient sorting is significantly inefficient on GPUs. In this paper, we conduct experiments that show the inefficiency of Top-k SGD and provide the insight of the low performance. Based on observations from our empirical analysis, we plan to yield a high performance gradient sparsification method as a future work.

In recent computer vision research, the advent of the Vision Transformer (ViT) has rapidly revolutionized various architectural design efforts: ViT achieved state-of-the-art image classification performance using self-attention found in natural language processing, and MLP-Mixer achieved competitive performance using simple multi-layer perceptrons. In contrast, several studies have also suggested that carefully redesigned convolutional neural networks (CNNs) can achieve advanced performance comparable to ViT without resorting to these new ideas. Against this background, there is growing interest in what inductive bias is suitable for computer vision. Here we propose Sequencer, a novel and competitive architecture alternative to ViT that provides a new perspective on these issues. Unlike ViTs, Sequencer models long-range dependencies using LSTMs rather than self-attention layers. We also propose a two-dimensional version of Sequencer module, where an LSTM is decomposed into vertical and horizontal LSTMs to enhance performance. Despite its simplicity, several experiments demonstrate that Sequencer performs impressively well: Sequencer2D-L, with 54M parameters, realizes 84.6% top-1 accuracy on only ImageNet-1K. Not only that, we show that it has good transferability and the robust resolution adaptability on double resolution-band.

Measuring uncertainties in the output of a deep learning method is useful in several ways, such as in assisting with interpretation of the outputs, helping build confidence with end users, and for improving the training and performance of the networks. Several different methods have been proposed to estimate uncertainties, including those from epistemic (relating to the model used) and aleatoric (relating to the data) sources using test-time dropout and augmentation, respectively. Not only are these uncertainty sources different, but they are governed by parameter settings (e.g., dropout rate or type and level of augmentation) that establish even more distinct uncertainty categories. This work investigates how different the uncertainties are from these categories, for magnitude and spatial pattern, to empirically address the question of whether they provide usefully distinct information that should be captured whenever uncertainties are used. We take the well characterised BraTS challenge dataset to demonstrate that there are substantial differences in both magnitude and spatial pattern of uncertainties from the different categories, and discuss the implications of these in various use cases.

Tensor decompositions are powerful tools for dimensionality reduction and feature interpretation of multidimensional data such as signals. Existing tensor decomposition objectives (e.g., Frobenius norm) are designed for fitting raw data under statistical assumptions, which may not align with downstream classification tasks. In practice, raw input tensors can contain irrelevant information while data augmentation techniques may be used to smooth out class-irrelevant noise in samples. This paper addresses the above challenges by proposing augmented tensor decomposition (ATD), which effectively incorporates data augmentations and self-supervised learning (SSL) to boost downstream classification. To address the non-convexity of the new augmented objective, we develop an iterative method that enables the optimization to follow an alternating least squares (ALS) fashion. We evaluate our proposed ATD on multiple datasets. It can achieve 0.8% - 2.5% accuracy gain over tensor-based baselines. Also, our ATD model shows comparable or better performance (e.g., up to 15% in accuracy) over self-supervised and autoencoder baselines while using less than 5% of learnable parameters of these baseline models

Node classification is an important task in graph neural networks, but most existing studies assume that samples from different classes are balanced. However, the class imbalance problem is widespread and can seriously affect the model's performance. Reducing the adverse effects of imbalanced datasets on model training is crucial to improve the model's performance. Therefore, a new loss function FD-Loss is reconstructed based on the traditional algorithm-level approach to the imbalance problem. Firstly, we propose sample mismeasurement distance to filter edge-hard samples and simple samples based on the distribution. Then, the weight coefficients are defined based on the mismeasurement distance and used in the loss function weighting term, so that the loss function focuses only on valuable samples. Experiments on several benchmarks demonstrate that our loss function can effectively solve the sample node imbalance problem and improve the classification accuracy by 4% compared to existing methods in the node classification task.

Deep-learning models have enabled performance leaps in analysis of high-dimensional functional MRI (fMRI) data. Yet, many previous methods are suboptimally sensitive for contextual representations across diverse time scales. Here, we present BolT, a blood-oxygen-level-dependent transformer model, for analyzing multi-variate fMRI time series. BolT leverages a cascade of transformer encoders equipped with a novel fused window attention mechanism. Encoding is performed on temporally-overlapped windows within the time series to capture local representations. To integrate information temporally, cross-window attention is computed between base tokens in each window and fringe tokens from neighboring windows. To gradually transition from local to global representations, the extent of window overlap and thereby number of fringe tokens are progressively increased across the cascade. Finally, a novel cross-window regularization is employed to align high-level classification features across the time series. Comprehensive experiments on large-scale public datasets demonstrate the superior performance of BolT against state-of-the-art methods. Furthermore, explanatory analyses to identify landmark time points and regions that contribute most significantly to model decisions corroborate prominent neuroscientific findings in the literature.

The convolutional neural networks (CNNs) are generally trained using stochastic gradient descent (SGD) based optimization techniques. The existing SGD optimizers generally suffer with the overshooting of the minimum and oscillation near minimum. In this paper, we propose a new approach, hereafter referred as AdaInject, for the gradient descent optimizers by injecting the second order moment into the first order moment. Specifically, the short-term change in parameter is used as a weight to inject the second order moment in the update rule. The AdaInject optimizer controls the parameter update, avoids the overshooting of the minimum and reduces the oscillation near minimum. The proposed approach is generic in nature and can be integrated with any existing SGD optimizer. The effectiveness of the AdaInject optimizer is explained intuitively as well as through some toy examples. We also show the convergence property of the proposed injection based optimizer. Further, we depict the efficacy of the AdaInject approach through extensive experiments in conjunction with the state-of-the-art optimizers, namely AdamInject, diffGradInject, RadamInject, and AdaBeliefInject on four benchmark datasets. Different CNN models are used in the experiments. A highest improvement in the top-1 classification error rate of $16.54\%$ is observed using diffGradInject optimizer with ResNeXt29 model over the CIFAR10 dataset. Overall, we observe very promising performance improvement of existing optimizers with the proposed AdaInject approach. The code is available at: \url{https://github.com/shivram1987/AdaInject}.

We design fast algorithms for repeatedly sampling from strongly Rayleigh distributions, which include random spanning tree distributions and determinantal point processes. For a graph $G=(V, E)$, we show how to approximately sample uniformly random spanning trees from $G$ in $\widetilde{O}(\lvert V\rvert)$ time per sample after an initial $\widetilde{O}(\lvert E\rvert)$ time preprocessing. For a determinantal point process on subsets of size $k$ of a ground set of $n$ elements, we show how to approximately sample in $\widetilde{O}(k^\omega)$ time after an initial $\widetilde{O}(nk^{\omega-1})$ time preprocessing, where $\omega<2.372864$ is the matrix multiplication exponent. We even improve the state of the art for obtaining a single sample from determinantal point processes, from the prior runtime of $\widetilde{O}(\min\{nk^2, n^\omega\})$ to $\widetilde{O}(nk^{\omega-1})$. In our main technical result, we achieve the optimal limit on domain sparsification for strongly Rayleigh distributions. In domain sparsification, sampling from a distribution $\mu$ on $\binom{[n]}{k}$ is reduced to sampling from related distributions on $\binom{[t]}{k}$ for $t\ll n$. We show that for strongly Rayleigh distributions, we can can achieve the optimal $t=\widetilde{O}(k)$. Our reduction involves sampling from $\widetilde{O}(1)$ domain-sparsified distributions, all of which can be produced efficiently assuming convenient access to approximate overestimates for marginals of $\mu$. Having access to marginals is analogous to having access to the mean and covariance of a continuous distribution, or knowing "isotropy" for the distribution, the key assumption behind the Kannan-Lov\'asz-Simonovits (KLS) conjecture and optimal samplers based on it. We view our result as a moral analog of the KLS conjecture and its consequences for sampling, for discrete strongly Rayleigh measures.

Learning sketching matrices for fast and accurate low-rank approximation (LRA) has gained increasing attention. Recently, Bartlett, Indyk, and Wagner (COLT 2022) presented a generalization bound for the learning-based LRA. Specifically, for rank-$k$ approximation using an $m \times n$ learned sketching matrix with $s$ non-zeros in each column, they proved an $\tilde{\mathrm{O}}(nsm)$ bound on the \emph{fat shattering dimension} ($\tilde{\mathrm{O}}$ hides logarithmic factors). We build on their work and make two contributions. 1. We present a better $\tilde{\mathrm{O}}(nsk)$ bound ($k \le m$). En route to obtaining the bound, we give a low-complexity \emph{Goldberg--Jerrum algorithm} for computing pseudo-inverse matrices, which would be of independent interest. 2. We alleviate an assumption of the previous study that the sparsity pattern of sketching matrices is fixed. We prove that learning positions of non-zeros increases the fat shattering dimension only by ${\mathrm{O}}(ns\log n)$. Also, experiments confirm the practical benefit of learning sparsity patterns.

While many multi-robot coordination problems can be solved optimally by exact algorithms, solutions are often not scalable in the number of robots. Multi-Agent Reinforcement Learning (MARL) is gaining increasing attention in the robotics community as a promising solution to tackle such problems. Nevertheless, we still lack the tools that allow us to quickly and efficiently find solutions to large-scale collective learning tasks. In this work, we introduce the Vectorized Multi-Agent Simulator (VMAS). VMAS is an open-source framework designed for efficient MARL benchmarking. It is comprised of a vectorized 2D physics engine written in PyTorch and a set of twelve challenging multi-robot scenarios. Additional scenarios can be implemented through a simple and modular interface. We demonstrate how vectorization enables parallel simulation on accelerated hardware without added complexity. When comparing VMAS to OpenAI MPE, we show how MPE's execution time increases linearly in the number of simulations while VMAS is able to execute 30,000 parallel simulations in under 10s, proving more than 100x faster. Using VMAS's RLlib interface, we benchmark our multi-robot scenarios using various Proximal Policy Optimization (PPO)-based MARL algorithms. VMAS's scenarios prove challenging in orthogonal ways for state-of-the-art MARL algorithms. The VMAS framework is available at https://github.com/proroklab/VectorizedMultiAgentSimulator. A video of VMAS scenarios and experiments is available at https://youtu.be/aaDRYfiesAY.

In our multicultural world, affect-aware AI systems that support humans need the ability to perceive affect across variations in emotion expression patterns across cultures. These systems must perform well in cultural contexts without annotated affect datasets available for training models. A standard assumption in affective computing is that affect recognition models trained and used within the same culture (intracultural) will perform better than models trained on one culture and used on different cultures (intercultural). We test this assumption and present the first systematic study of intercultural affect recognition models using videos of real-world dyadic interactions from six cultures. We develop an attention-based feature selection approach under temporal causal discovery to identify behavioral cues that can be leveraged in intercultural affect recognition models. Across all six cultures, our findings demonstrate that intercultural affect recognition models were as effective or more effective than intracultural models. We identify and contribute useful behavioral features for intercultural affect recognition; facial features from the visual modality were more useful than the audio modality in this study's context. Our paper presents a proof-of-concept and motivation for the future development of intercultural affect recognition systems, especially those deployed in low-resource situations without annotated data.

Both in academic and industry-based research, online evaluation methods are seen as the golden standard for interactive applications like recommendation systems. Naturally, the reason for this is that we can directly measure utility metrics that rely on interventions, being the recommendations that are being shown to users. Nevertheless, online evaluation methods are costly for a number of reasons, and a clear need remains for reliable offline evaluation procedures. In industry, offline metrics are often used as a first-line evaluation to generate promising candidate models to evaluate online. In academic work, limited access to online systems makes offline metrics the de facto approach to validating novel methods. Two classes of offline metrics exist: proxy-based methods, and counterfactual methods. The first class is often poorly correlated with the online metrics we care about, and the latter class only provides theoretical guarantees under assumptions that cannot be fulfilled in real-world environments. Here, we make the case that simulation-based comparisons provide ways forward beyond offline metrics, and argue that they are a preferable means of evaluation.

Deep Reinforcement Learning (DRL) algorithms can scale to previously intractable problems. The automation of profit generation in the stock market is possible using DRL, by combining the financial assets price "prediction" step and the "allocation" step of the portfolio in one unified process to produce fully autonomous systems capable of interacting with their environment to make optimal decisions through trial and error. This work represents a DRL model to generate profitable trades in the stock market, effectively overcoming the limitations of supervised learning approaches. We formulate the trading problem as a Partially Observed Markov Decision Process (POMDP) model, considering the constraints imposed by the stock market, such as liquidity and transaction costs. We then solve the formulated POMDP problem using the Twin Delayed Deep Deterministic Policy Gradient (TD3) algorithm reporting a 2.68 Sharpe Ratio on unseen data set (test data). From the point of view of stock market forecasting and the intelligent decision-making mechanism, this paper demonstrates the superiority of DRL in financial markets over other types of machine learning and proves its credibility and advantages of strategic decision-making.

Development of an accurate, flexible, and numerically efficient uncertainty quantification (UQ) method is one of fundamental challenges in machine learning. Previously, a UQ method called DISCO Nets has been proposed (Bouchacourt et al., 2016) that trains a neural network by minimizing the so-called energy score on training data. This method has shown superior performance on a hand pose estimation task in computer vision, but it remained unclear whether this method works as nicely for regression on tabular data, and how it competes with more recent advanced UQ methods such as NGBoost. In this paper, we propose an improved neural architecture of DISCO Nets that admits a more stable and smooth training. We benchmark this approach on miscellaneous real-world tabular datasets and confirm that it is competitive with or even superior to standard UQ baselines. We also provide a new elementary proof for the validity of using the energy score to learn predictive distributions. Further, we point out that DISCO Nets in its original form ignore epistemic uncertainty and only capture aleatoric uncertainty. We propose a simple fix to this problem.

Meta-learning is a branch of machine learning which trains neural network models to synthesize a wide variety of data in order to rapidly solve new problems. In process control, many systems have similar and well-understood dynamics, which suggests it is feasible to create a generalizable controller through meta-learning. In this work, we formulate a meta reinforcement learning (meta-RL) control strategy that can be used to tune proportional--integral controllers. Our meta-RL agent has a recurrent structure that accumulates "context" to learn a system's dynamics through a hidden state variable in closed-loop. This architecture enables the agent to automatically adapt to changes in the process dynamics. In tests reported here, the meta-RL agent was trained entirely offline on first order plus time delay systems, and produced excellent results on novel systems drawn from the same distribution of process dynamics used for training. A key design element is the ability to leverage model-based information offline during training in simulated environments while maintaining a model-free policy structure for interacting with novel processes where there is uncertainty regarding the true process dynamics. Meta-learning is a promising approach for constructing sample-efficient intelligent controllers.

We provide a decision theoretic analysis of bandit experiments. Working within the framework of diffusion asymptotics, we define suitable notions of asymptotic Bayes and minimax risk for these experiments. For normally distributed rewards, the minimal Bayes risk can be characterized as the solution to a second-order partial differential equation (PDE). Using a limit of experiments approach, we show that this PDE characterization also holds asymptotically under both parametric and non-parametric distributions of the rewards. The approach further describes the state variables it is asymptotically sufficient to restrict attention to, and thereby suggests a practical strategy for dimension reduction. The PDEs characterizing minimal Bayes risk can be solved efficiently using sparse matrix routines. We derive the optimal Bayes and minimax policies from their numerical solutions. These optimal policies substantially dominate existing methods such as Thompson sampling and UCB, often by a factor of two. The framework also covers time discounting and pure exploration.

Federated learning learns a neural network model by aggregating the knowledge from a group of distributed clients under the privacy-preserving constraint. In this work, we show that this paradigm might inherit the adversarial vulnerability of the centralized neural network, i.e., it has deteriorated performance on adversarial examples when the model is deployed. This is even more alarming when federated learning paradigm is designed to approximate the updating behavior of a centralized neural network. To solve this problem, we propose an adversarially robust federated learning framework, named Fed_BVA, with improved server and client update mechanisms. This is motivated by our observation that the generalization error in federated learning can be naturally decomposed into the bias and variance triggered by multiple clients' predictions. Thus, we propose to generate the adversarial examples via maximizing the bias and variance during server update, and learn the adversarially robust model updates with those examples during client update. As a result, an adversarially robust neural network can be aggregated from these improved local clients' model updates. The experiments are conducted on multiple benchmark data sets using several prevalent neural network models, and the empirical results show that our framework is robust against white-box and black-box adversarial corruptions under both IID and non-IID settings.

In the pursuit of explaining implicit regularization in deep learning, prominent focus was given to matrix and tensor factorizations, which correspond to simplified neural networks. It was shown that these models exhibit an implicit tendency towards low matrix and tensor ranks, respectively. Drawing closer to practical deep learning, the current paper theoretically analyzes the implicit regularization in hierarchical tensor factorization, a model equivalent to certain deep convolutional neural networks. Through a dynamical systems lens, we overcome challenges associated with hierarchy, and establish implicit regularization towards low hierarchical tensor rank. This translates to an implicit regularization towards locality for the associated convolutional networks. Inspired by our theory, we design explicit regularization discouraging locality, and demonstrate its ability to improve the performance of modern convolutional networks on non-local tasks, in defiance of conventional wisdom by which architectural changes are needed. Our work highlights the potential of enhancing neural networks via theoretical analysis of their implicit regularization.

Deep learning is a standard tool in the field of high-energy physics, facilitating considerable sensitivity enhancements for numerous analysis strategies. In particular, in identification of physics objects, such as jet flavor tagging, complex neural network architectures play a major role. However, these methods are reliant on accurate simulations. Mismodeling can lead to non-negligible differences in performance in data that need to be measured and calibrated against. We investigate the classifier response to input data with injected mismodelings and probe the vulnerability of flavor tagging algorithms via application of adversarial attacks. Subsequently, we present an adversarial training strategy that mitigates the impact of such simulated attacks and improves the classifier robustness. We examine the relationship between performance and vulnerability and show that this method constitutes a promising approach to reduce the vulnerability to poor modeling.

Minority groups have been using social media to organize social movements that create profound social impacts. Black Lives Matter (BLM) and Stop Asian Hate (SAH) are two successful social movements that have spread on Twitter that promote protests and activities against racism and increase the public's awareness of other social challenges that minority groups face. However, previous studies have mostly conducted qualitative analyses of tweets or interviews with users, which may not comprehensively and validly represent all tweets. Very few studies have explored the Twitter topics within BLM and SAH dialogs in a rigorous, quantified and data-centered approach. Therefore, in this research, we adopted a mixed-methods approach to comprehensively analyze BLM and SAH Twitter topics. We implemented (1) the latent Dirichlet allocation model to understand the top high-level words and topics and (2) open-coding analysis to identify specific themes across the tweets. We collected more than one million tweets with the #blacklivesmatter and #stopasianhate hashtags and compared their topics. Our findings revealed that the tweets discussed a variety of influential topics in depth, and social justice, social movements, and emotional sentiments were common topics in both movements, though with unique subtopics for each movement. Our study contributes to the topic analysis of social movements on social media platforms in particular and the literature on the interplay of AI, ethics, and society in general.

We study methods for task-agnostic continual reinforcement learning (TACRL). TACRL is a setting that combines the difficulties of partially-observable RL (a consequence of task agnosticism) and the difficulties of continual learning (CL), i.e., learning on a non-stationary sequence of tasks. We compare TACRL methods with their soft upper bounds prescribed by previous literature: multi-task learning (MTL) methods which do not have to deal with non-stationary data distributions, as well as task-aware methods, which are allowed to operate under full observability. We consider a previously unexplored and straightforward baseline for TACRL, replay-based recurrent RL (3RL), in which we augment an RL algorithm with recurrent mechanisms to mitigate partial observability and experience replay mechanisms for catastrophic forgetting in CL. By studying empirical performance in a sequence of RL tasks, we find surprising occurrences of 3RL matching and overcoming the MTL and task-aware soft upper bounds. We lay out hypotheses that could explain this inflection point of continual and task-agnostic learning research. Our hypotheses are empirically tested in continuous control tasks via a large-scale study of the popular multi-task and continual learning benchmark Meta-World. By analyzing different training statistics including gradient conflict, we find evidence that 3RL's outperformance stems from its ability to quickly infer how new tasks relate with the previous ones, enabling forward transfer.

If the trend of learned components eventually outperforming their hand-crafted version continues, learned optimizers will eventually outperform hand-crafted optimizers like SGD or Adam. Even if learned optimizers (L2Os) eventually outpace hand-crafted ones in practice however, they are still not provably convergent and might fail out of distribution. These are the questions addressed here. Currently, learned optimizers frequently outperform generic hand-crafted optimizers (such as gradient descent) at the beginning of learning but they generally plateau after some time while the generic algorithms continue to make progress and often overtake the learned algorithm as Aesop's tortoise which overtakes the hare. L2Os also still have a difficult time generalizing out of distribution. Heaton et al. proposed Safeguarded L2O (GL2O) which can take a learned optimizer and safeguard it with a generic learning algorithm so that by conditionally switching between the two, the resulting algorithm is provably convergent. We propose a new class of Safeguarded L2O, called Loss-Guarded L2O (LGL2O), which is both conceptually simpler and computationally less expensive. The guarding mechanism decides solely based on the expected future loss value of both optimizers. Furthermore, we show theoretical proof of LGL2O's convergence guarantee and empirical results comparing to GL2O and other baselines showing that it combines the best of both L2O and SGD and that in practice converges much better than GL2O.

With model trustworthiness being crucial for sensitive real-world applications, practitioners are putting more and more focus on improving the uncertainty calibration of deep neural networks. Calibration errors are designed to quantify the reliability of probabilistic predictions but their estimators are usually biased and inconsistent. In this work, we introduce the framework of proper calibration errors, which relates every calibration error to a proper score and provides a respective upper bound with optimal estimation properties. This relationship can be used to reliably quantify the model calibration improvement. We theoretically and empirically demonstrate the shortcomings of commonly used estimators compared to our approach. Due to the wide applicability of proper scores, this gives a natural extension of recalibration beyond classification.

We hypothesize that due to the greedy nature of learning in multi-modal deep neural networks, these models tend to rely on just one modality while under-fitting the other modalities. Such behavior is counter-intuitive and hurts the models' generalization, as we observe empirically. To estimate the model's dependence on each modality, we compute the gain on the accuracy when the model has access to it in addition to another modality. We refer to this gain as the conditional utilization rate. In the experiments, we consistently observe an imbalance in conditional utilization rates between modalities, across multiple tasks and architectures. Since conditional utilization rate cannot be computed efficiently during training, we introduce a proxy for it based on the pace at which the model learns from each modality, which we refer to as the conditional learning speed. We propose an algorithm to balance the conditional learning speeds between modalities during training and demonstrate that it indeed addresses the issue of greedy learning. The proposed algorithm improves the model's generalization on three datasets: Colored MNIST, ModelNet40, and NVIDIA Dynamic Hand Gesture.

Over the last two decades, the robotics community witnessed the emergence of various motion representations that have been used extensively, particularly in behavorial cloning, to compactly encode and generalize skills. Among these, probabilistic approaches have earned a relevant place, owing to their encoding of variations, correlations and adaptability to new task conditions. Modulating such primitives, however, is often cumbersome due to the need for parameter re-optimization which frequently entails computationally costly operations. In this paper we derive a non-parametric movement primitive formulation that contains a null space projector. We show that such formulation allows for fast and efficient motion generation with computational complexity O(n2) without involving matrix inversions, whose complexity is O(n3). This is achieved by using the null space to track secondary targets, with a precision determined by the training dataset. Using a 2D example associated with time input we show that our non-parametric solution compares favourably with a state-of-the-art parametric approach. For demonstrated skills with high-dimensional inputs we show that it permits on-the-fly adaptation as well.

Although machine learning on hypergraphs has attracted considerable attention, most of the works have focused on (semi-)supervised learning, which may cause heavy labeling costs and poor generalization. Recently, contrastive learning has emerged as a successful unsupervised representation learning method. Despite the prosperous development of contrastive learning in other domains, contrastive learning on hypergraphs remains little explored. In this paper, we propose TriCL (Tri-directional Contrastive Learning), a general framework for contrastive learning on hypergraphs. Its main idea is tri-directional contrast, and specifically, it aims to maximize in two augmented views the agreement (a) between the same node, (b) between the same group of nodes, and (c) between each group and its members. Together with simple but surprisingly effective data augmentation and negative sampling schemes, these three forms of contrast enable TriCL to capture both microscopic and mesoscopic structural information in node embeddings. Our extensive experiments using 13 baseline approaches, five datasets, and two tasks demonstrate the effectiveness of TriCL, and most noticeably, TriCL consistently outperforms not just unsupervised competitors but also (semi-)supervised competitors mostly by significant margins for node classification.

It is now a standard for neural network representations to be trained on large, publicly available datasets, and used for new problems. The reasons for why neural network representations have been so successful for transfer, however, are still not fully understood. In this paper we show that, after training, neural network representations align their top singular vectors to the targets. We investigate this representation alignment phenomenon in a variety of neural network architectures and find that (a) alignment emerges across a variety of different architectures and optimizers, with more alignment arising from depth (b) alignment increases for layers closer to the output and (c) existing high-performance deep CNNs exhibit high levels of alignment. We then highlight why alignment between the top singular vectors and the targets can speed up learning and show in a classic synthetic transfer problem that representation alignment correlates with positive and negative transfer to similar and dissimilar tasks.

The data article describes the Road Damage Dataset, RDD2022, which comprises 47,420 road images from six countries, Japan, India, the Czech Republic, Norway, the United States, and China. The images have been annotated with more than 55,000 instances of road damage. Four types of road damage, namely longitudinal cracks, transverse cracks, alligator cracks, and potholes, are captured in the dataset. The annotated dataset is envisioned for developing deep learning-based methods to detect and classify road damage automatically. The dataset has been released as a part of the Crowd sensing-based Road Damage Detection Challenge (CRDDC2022). The challenge CRDDC2022 invites researchers from across the globe to propose solutions for automatic road damage detection in multiple countries. The municipalities and road agencies may utilize the RDD2022 dataset, and the models trained using RDD2022 for low-cost automatic monitoring of road conditions. Further, computer vision and machine learning researchers may use the dataset to benchmark the performance of different algorithms for other image-based applications of the same type (classification, object detection, etc.).

Learning effective protein representations is critical in a variety of tasks in biology such as predicting protein function or structure. Existing approaches usually pretrain protein language models on a large number of unlabeled amino acid sequences and then finetune the models with some labeled data in downstream tasks. Despite the effectiveness of sequence-based approaches, the power of pretraining on known protein structures, which are available in smaller numbers only, has not been explored for protein property prediction, though protein structures are known to be determinants of protein function. In this paper, we propose to pretrain protein representations according to their 3D structures. We first present a simple yet effective encoder to learn the geometric features of a protein. We pretrain the protein graph encoder by leveraging multiview contrastive learning and different self-prediction tasks. Experimental results on both function prediction and fold classification tasks show that our proposed pretraining methods outperform or are on par with the state-of-the-art sequence-based methods, while using much less data. Our implementation is available at https://github.com/DeepGraphLearning/GearNet.

Low-rank tensor completion (LRTC) is an important problem in computer vision and machine learning. The minimax-concave penalty (MCP) function as a non-convex relaxation has achieved good results in the LRTC problem. To makes all the constant parameters of the MCP function as variables so that futherly improving the adaptability to the change of singular values in the LRTC problem, we propose the bivariate equivalent minimax-concave penalty (BEMCP) theorem. Applying the BEMCP theorem to tensor singular values leads to the bivariate equivalent weighted tensor $\Gamma$-norm (BEWTGN) theorem, and we analyze and discuss its corresponding properties. Besides, to facilitate the solution of the LRTC problem, we give the proximal operators of the BEMCP theorem and BEWTGN. Meanwhile, we propose a BEMCP model for the LRTC problem, which is optimally solved based on alternating direction multiplier (ADMM). Finally, the proposed method is applied to the data restorations of multispectral image (MSI), magnetic resonance imaging (MRI) and color video (CV) in real-world, and the experimental results demonstrate that it outperforms the state-of-arts methods.

Class imbalance poses a major challenge for machine learning as most supervised learning models might exhibit bias towards the majority class and under-perform in the minority class. Cost-sensitive learning tackles this problem by treating the classes differently, formulated typically via a user-defined fixed misclassification cost matrix provided as input to the learner. Such parameter tuning is a challenging task that requires domain knowledge and moreover, wrong adjustments might lead to overall predictive performance deterioration. In this work, we propose a novel cost-sensitive boosting approach for imbalanced data that dynamically adjusts the misclassification costs over the boosting rounds in response to model's performance instead of using a fixed misclassification cost matrix. Our method, called AdaCC, is parameter-free as it relies on the cumulative behavior of the boosting model in order to adjust the misclassification costs for the next boosting round and comes with theoretical guarantees regarding the training error. Experiments on 27 real-world datasets from different domains with high class imbalance demonstrate the superiority of our method over 12 state-of-the-art cost-sensitive boosting approaches exhibiting consistent improvements in different measures, for instance, in the range of [0.3%-28.56%] for AUC, [3.4%-21.4%] for balanced accuracy, [4.8%-45%] for gmean and [7.4%-85.5%] for recall.

Quantum computing is expected to have transformative influences on many domains, but its practical deployments on industry problems are underexplored. We focus on applying quantum computing to operations management problems in industry, and in particular, supply chain management. Many problems in supply chain management involve large state and action spaces and pose computational challenges on classic computers. We develop a quantized policy iteration algorithm to solve an inventory control problem and demonstrative its effectiveness. We also discuss in-depth the hardware requirements and potential challenges on implementing this quantum algorithm in the near term. Our simulations and experiments are powered by the IBM Qiskit and the qBraid system.

Evaluating robustness of machine-learning models to adversarial examples is a challenging problem. Many defenses have been shown to provide a false sense of robustness by causing gradient-based attacks to fail, and they have been broken under more rigorous evaluations. Although guidelines and best practices have been suggested to improve current adversarial robustness evaluations, the lack of automatic testing and debugging tools makes it difficult to apply these recommendations in a systematic manner. In this work, we overcome these limitations by: (i) categorizing attack failures based on how they affect the optimization of gradient-based attacks, while also unveiling two novel failures affecting many popular attack implementations and past evaluations; (ii) proposing six novel indicators of failure, to automatically detect the presence of such failures in the attack optimization process; and (iii) suggesting a systematic protocol to apply the corresponding fixes. Our extensive experimental analysis, involving more than 15 models in 3 distinct application domains, shows that our indicators of failure can be used to debug and improve current adversarial robustness evaluations, thereby providing a first concrete step towards automatizing and systematizing them. Our open-source code is available at: https://github.com/pralab/IndicatorsOfAttackFailure.

The task of out-of-distribution (OOD) detection is crucial for deploying machine learning models in real-world settings. In this paper, we observe that the singular value distributions of the in-distribution (ID) and OOD features are quite different: the OOD feature matrix tends to have a larger dominant singular value than the ID feature, and the class predictions of OOD samples are largely determined by it. This observation motivates us to propose \texttt{RankFeat}, a simple yet effective \texttt{post hoc} approach for OOD detection by removing the rank-1 matrix composed of the largest singular value and the associated singular vectors from the high-level feature (\emph{i.e.,} $\mathbf{X}{-} \mathbf{s}_{1}\mathbf{u}_{1}\mathbf{v}_{1}^{T}$). \texttt{RankFeat} achieves the \emph{state-of-the-art} performance and reduces the average false positive rate (FPR95) by 17.90\% compared with the previous best method. Extensive ablation studies and comprehensive theoretical analyses are presented to support the empirical results.

Many applications such as hiring and university admissions involve evaluation and selection of applicants. These tasks are fundamentally difficult, and require combining evidence from multiple different aspects (what we term "attributes"). In these applications, the number of applicants is often large, and a common practice is to assign the task to multiple evaluators in a distributed fashion. Specifically, in the often-used holistic allocation, each evaluator is assigned a subset of the applicants, and is asked to assess all relevant information for their assigned applicants. However, such an evaluation process is subject to issues such as miscalibration (evaluators see only a small fraction of the applicants and may not get a good sense of relative quality), and discrimination (evaluators are influenced by irrelevant information about the applicants). We identify that such attribute-based evaluation allows alternative allocation schemes. Specifically, we consider assigning each evaluator more applicants but fewer attributes per applicant, termed segmented allocation. We compare segmented allocation to holistic allocation on several dimensions via theoretical and experimental methods. We establish various tradeoffs between these two approaches, and identify conditions under which one approach results in more accurate evaluation than the other.

The paper describes neural models developed for the DAGPap22 shared task hosted at the Third Workshop on Scholarly Document Processing. This shared task targets the automatic detection of generated scientific papers. Our work focuses on comparing different transformer-based models as well as using additional datasets and techniques to deal with imbalanced classes. As a final submission, we utilized an ensemble of SciBERT, RoBERTa, and DeBERTa fine-tuned using random oversampling technique. Our model achieved 99.24% in terms of F1-score. The official evaluation results have put our system at the third place.

Despite recent studies on understanding deep neural networks (DNNs), there exists numerous questions on how DNNs generate their predictions. Especially, given similar predictions on different input samples, are the underlying mechanisms generating those predictions the same? In this work, we propose NeuCEPT, a method to locally discover critical neurons that play a major role in the model's predictions and identify model's mechanisms in generating those predictions. We first formulate a critical neurons identification problem as maximizing a sequence of mutual-information objectives and provide a theoretical framework to efficiently solve for critical neurons while keeping the precision under control. NeuCEPT next heuristically learns different model's mechanisms in an unsupervised manner. Our experimental results show that neurons identified by NeuCEPT not only have strong influence on the model's predictions but also hold meaningful information about model's mechanisms.

Outlier detection (OD) is a key learning task for finding rare and deviant data samples, with many time-critical applications such as fraud detection and intrusion detection. In this work, we propose TOD, the first tensor-based system for efficient and scalable outlier detection on distributed multi-GPU machines. A key idea behind TOD is decomposing complex OD applications into a small collection of basic tensor algebra operators. This decomposition enables TOD to accelerate OD computations by leveraging recent advances in deep learning infrastructure in both hardware and software. Moreover, to deploy memory-intensive OD applications on modern GPUs with limited on-device memory, we introduce two key techniques. First, provable quantization speeds up OD computations and reduces its memory footprint by automatically performing specific floating-point operations in lower precision while provably guaranteeing no accuracy loss. Second, to exploit the aggregated compute resources and memory capacity of multiple GPUs, we introduce automatic batching, which decomposes OD computations into small batches for both sequential execution on a single GPU and parallel execution on multiple GPUs. TOD supports a diverse set of OD algorithms. Extensive evaluation on 11 real and 3 synthetic OD datasets shows that TOD is on average 10.9x faster than the leading CPU-based OD system PyOD (with a maximum speedup of 38.9x), and can handle much larger datasets than existing GPU-based OD systems. In addition, TOD allows easy integration of new OD operators, enabling fast prototyping of emerging and yet-to-discovered OD algorithms.

Deep-learning-based hyperspectral image (HSI) restoration methods have gained great popularity for their remarkable performance but often demand expensive network retraining whenever the specifics of task changes. In this paper, we propose to restore HSIs in a unified approach with an effective plug-and-play method, which can jointly retain the flexibility of optimization-based methods and utilize the powerful representation capability of deep neural networks. Specifically, we first develop a new deep HSI denoiser leveraging gated recurrent convolution units, short- and long-term skip connections, and an augmented noise level map to better exploit the abundant spatio-spectral information within HSIs. It, therefore, leads to the state-of-the-art performance on HSI denoising under both Gaussian and complex noise settings. Then, the proposed denoiser is inserted into the plug-and-play framework as a powerful implicit HSI prior to tackle various HSI restoration tasks. Through extensive experiments on HSI super-resolution, compressed sensing, and inpainting, we demonstrate that our approach often achieves superior performance, which is competitive with or even better than the state-of-the-art on each task, via a single model without any task-specific training.

The autism dataset is studied to identify the differences between autistic and healthy groups. For this, the resting-state Functional Magnetic Resonance Imaging (rs-fMRI) data of the two groups are analyzed, and networks of connections between brain regions were created. Several classification frameworks are developed to distinguish the connectivity patterns between the groups. The best models for statistical inference and precision were compared, and the tradeoff between precision and model interpretability was analyzed. Finally, the classification accuracy measures were reported to justify the performance of our framework. Our best model can classify autistic and healthy patients on the multisite ABIDE I data with 71% accuracy.

Most of the existing algorithms for zero-shot classification problems typically rely on the attribute-based semantic relations among categories to realize the classification of novel categories without observing any of their instances. However, training the zero-shot classification models still requires attribute labeling for each class (or even instance) in the training dataset, which is also expensive. To this end, in this paper, we bring up a new problem scenario: "Can we derive zero-shot learning for novel attribute detectors/classifiers and use them to automatically annotate the dataset for labeling efficiency?". Basically, given only a small set of detectors that are learned to recognize some manually annotated attributes (i.e., the seen attributes), we aim to synthesize the detectors of novel attributes in a zero-shot learning manner. Our proposed method, Zero-Shot Learning for Attributes (ZSLA), which is the first of its kind to the best of our knowledge, tackles this new research problem by applying the set operations to first decompose the seen attributes into their basic attributes and then recombine these basic attributes into the novel ones. Extensive experiments are conducted to verify the capacity of our synthesized detectors for accurately capturing the semantics of the novel attributes and show their superior performance in terms of detection and localization compared to other baseline approaches. Moreover, we demonstrate the application of automatic annotation using our synthesized detectors on Caltech-UCSD Birds-200-2011 dataset. Various generalized zero-shot classification algorithms trained upon the dataset re-annotated by ZSLA show comparable performance with those trained with the manual ground-truth annotations. Please refer to our project page for source code: https://yuhsuanli.github.io/ZSLA/

Recommender systems, which offer personalized suggestions to users, power many of today's social media, e-commerce and entertainment. However, these systems have been known to intellectually isolate users from a variety of perspectives, or cause filter bubbles. In our work, we characterize and mitigate this filter bubble effect. We do so by classifying various datapoints based on their user-item interaction history and calculating the influences of the classified categories on each other using the well known TracIn method. Finally, we mitigate this filter bubble effect without compromising accuracy by carefully retraining our recommender system.

In the last few years, many explanation methods based on the perturbations of input data have been introduced to improve our understanding of decisions made by black-box models. The goal of this work is to introduce a novel perturbation scheme so that more faithful and robust explanations can be obtained. Our study focuses on the impact of perturbing directions on the data topology. We show that perturbing along the orthogonal directions of the input manifold better preserves the data topology, both in the worst-case analysis of the discrete Gromov-Hausdorff distance and in the average-case analysis via persistent homology. From those results, we introduce EMaP algorithm, realizing the orthogonal perturbation scheme. Our experiments show that EMaP not only improves the explainers' performance but also helps them overcome a recently-developed attack against perturbation-based methods.

Conventional works generally employ a two-phase model in which a generator selects the most important pieces, followed by a predictor that makes predictions based on the selected pieces. However, such a two-phase model may incur the degeneration problem where the predictor overfits to the noise generated by a not yet well-trained generator and in turn, leads the generator to converge to a sub-optimal model that tends to select senseless pieces. To tackle this challenge, we propose Folded Rationalization (FR) that folds the two phases of the rationale model into one from the perspective of text semantic extraction. The key idea of FR is to employ a unified encoder between the generator and predictor, based on which FR can facilitate a better predictor by access to valuable information blocked by the generator in the traditional two-phase model and thus bring a better generator. Empirically, we show that FR improves the F1 score by up to 10.3% as compared to state-of-the-art methods.

Medical imaging deep learning models are often large and complex, requiring specialized hardware to train and evaluate these models. To address such issues, we propose the PocketNet paradigm to reduce the size of deep learning models by throttling the growth of the number of channels in convolutional neural networks. We demonstrate that, for a range of segmentation and classification tasks, PocketNet architectures produce results comparable to that of conventional neural networks while reducing the number of parameters by multiple orders of magnitude, using up to 90% less GPU memory, and speeding up training times by up to 40%, thereby allowing such models to be trained and deployed in resource-constrained settings.

Off-policy Evaluation (OPE) methods are crucial tools for evaluating policies in high-stakes domains such as healthcare, where direct deployment is often infeasible, unethical, or expensive. When deployment environments are expected to undergo changes (that is, dataset shifts), it is important for OPE methods to perform robust evaluation of the policies amidst such changes. Existing approaches consider robustness against a large class of shifts that can arbitrarily change any observable property of the environment. This often results in highly pessimistic estimates of the utilities, thereby invalidating policies that might have been useful in deployment. In this work, we address the aforementioned problem by investigating how domain knowledge can help provide more realistic estimates of the utilities of policies. We leverage human inputs on which aspects of the environments may plausibly change, and adapt the OPE methods to only consider shifts on these aspects. Specifically, we propose a novel framework, Robust OPE (ROPE), which considers shifts on a subset of covariates in the data based on user inputs, and estimates worst-case utility under these shifts. We then develop computationally efficient algorithms for OPE that are robust to the aforementioned shifts for contextual bandits and Markov decision processes. We also theoretically analyze the sample complexity of these algorithms. Extensive experimentation with synthetic and real world datasets from the healthcare domain demonstrates that our approach not only captures realistic dataset shifts accurately, but also results in less pessimistic policy evaluations.

Recent studies have shown that autoencoder-based models can achieve superior performance on anomaly detection tasks due to their excellent ability to fit complex data in an unsupervised manner. In this work, we propose a novel autoencoder-based model, named StackVAE-G that can significantly bring the efficiency and interpretability to multivariate time series anomaly detection. Specifically, we utilize the similarities across the time series channels by the stacking block-wise reconstruction with a weight-sharing scheme to reduce the size of learned models and also relieve the overfitting to unknown noises in the training data. We also leverage a graph learning module to learn a sparse adjacency matrix to explicitly capture the stable interrelation structure among multiple time series channels for the interpretable pattern reconstruction of interrelated channels. Combining these two modules, we introduce the stacking block-wise VAE (variational autoencoder) with GNN (graph neural network) model for multivariate time series anomaly detection. We conduct extensive experiments on three commonly used public datasets, showing that our model achieves comparable (even better) performance with the state-of-the-art modelsand meanwhile requires much less computation and memory cost. Furthermore, we demonstrate that the adjacency matrix learned by our model accurately captures the interrelation among multiple channels, and can provide valuable information for failure diagnosis applications.

Coordination graph is a promising approach to model agent collaboration in multi-agent reinforcement learning. It conducts a graph-based value factorization and induces explicit coordination among agents to complete complicated tasks. However, one critical challenge in this paradigm is the complexity of greedy action selection with respect to the factorized values. It refers to the decentralized constraint optimization problem (DCOP), which and whose constant-ratio approximation are NP-hard problems. To bypass this systematic hardness, this paper proposes a novel method, named Self-Organized Polynomial-time Coordination Graphs (SOP-CG), which uses structured graph classes to guarantee the accuracy and the computational efficiency of collaborated action selection. SOP-CG employs dynamic graph topology to ensure sufficient value function expressiveness. The graph selection is unified into an end-to-end learning paradigm. In experiments, we show that our approach learns succinct and well-adapted graph topologies, induces effective coordination, and improves performance across a variety of cooperative multi-agent tasks.

Machine Learning Techniques, properly combined with Data Structures, have resulted in Learned Static Indexes, innovative and powerful tools that speed-up Binary Search, with the use of additional space with respect to the table being searched into. Such space is devoted to the Machine Learning Model. Although in their infancy, they are methodologically and practically important, due to the pervasiveness of Sorted Table Search procedures. In modern applications, model space is a key factor and, in fact, a major open question concerning this area is to assess to what extent one can enjoy the speed-up of Binary Search achieved by Learned Indexes while using constant or nearly constant space models. In this paper, we investigate the mentioned question by (a) introducing two new models, i.e., the Learned k-ary Search Model and the Synoptic Recursive Model Index, respectively; (b) systematically exploring the time-space trade-offs of a hierarchy of existing models, i.e., the ones in the reference software platform Searching on Sorted Data, together with the new ones proposed here. By adhering and extending the current benchmarking methodology, we experimentally show that the Learned k-ary Search Model can speed up Binary Search in constant additional space. Our second model, together with the bi-criteria Piece-wise Geometric Model index, can achieve a speed-up of Binary Search with a model space of 0:05% more than the one taken by the table, being competitive in terms of time-space trade-off with existing proposals. The Synoptic Recursive Model Index and the bi-criteria Piece-wise Geometric Model complement each other quite well across the various levels of the internal memory hierarchy. Finally, our findings stimulate research in this area, since they highlight the need for further studies regarding the time-space relation in Learned Indexes.

Neural Networks are prone to having lesser accuracy in the classification of images with noise perturbation. Convolutional Neural Networks, CNNs are known for their unparalleled accuracy in the classification of benign images. But our study shows that they are extremely vulnerable to noise addition while Feed-forward Neural Networks, FNNs show very less correspondence with noise perturbation, maintaining their accuracy almost undisturbed. FNNs are observed to be better at classifying noise-intensive, single-channeled images that are just sheer noise to human vision. In our study, we have used the hand-written digits dataset, MNIST with the following architectures: FNNs with 1 and 2 hidden layers and CNNs with 3, 4, 6 and 8 convolutions and analyzed their accuracies. FNNs stand out to show that irrespective of the intensity of noise, they have a classification accuracy of more than 85%. In our analysis of CNNs with this data, the deceleration of classification accuracy of CNN with 8 convolutions was half of that of the rest of the CNNs. Correlation analysis and mathematical modelling of the accuracy trends act as roadmaps to these conclusions.

Node clustering is a powerful tool in the analysis of networks. We introduce a graph neural network framework to obtain node embeddings for directed networks in a self-supervised manner, including a novel probabilistic imbalance loss, which can be used for network clustering. Here, we propose directed flow imbalance measures, which are tightly related to directionality, to reveal clusters in the network even when there is no density difference between clusters. In contrast to standard approaches in the literature, in this paper, directionality is not treated as a nuisance, but rather contains the main signal. DIGRAC optimizes directed flow imbalance for clustering without requiring label supervision, unlike existing graph neural network methods, and can naturally incorporate node features, unlike existing spectral methods. Extensive experimental results on synthetic data, in the form of directed stochastic block models, and real-world data at different scales, demonstrate that our method, based on flow imbalance, attains state-of-the-art results on directed graph clustering when compared against 10 state-of-the-art methods from the literature, for a wide range of noise and sparsity levels, graph structures and topologies, and even outperforms supervised methods.

Characterizing the sensing and communication performance tradeoff in integrated sensing and communication (ISAC) systems is challenging in the applications of learning-based human motion recognition. This is because of the large experimental datasets and the black-box nature of deep neural networks. This paper presents SDP3, a Simulation-Driven Performance Predictor and oPtimizer, which consists of SDP3 data simulator, SDP3 performance predictor and SDP3 performance optimizer. Specifically, the SDP3 data simulator generates vivid wireless sensing datasets in a virtual environment, the SDP3 performance predictor predicts the sensing performance based on the function regression method, and the SDP3 performance optimizer investigates the sensing and communication performance tradeoff analytically. It is shown that the simulated sensing dataset matches the experimental dataset very well in the motion recognition accuracy. By leveraging SDP3, it is found that the achievable region of recognition accuracy and communication throughput consists of a communication saturation zone, a sensing saturation zone, and a communication-sensing adversarial zone, of which the desired balanced performance for ISAC systems lies in the third one.

Cryo-Electron Microscopy (cryo-EM) has emerged as a key technology to determine the structure of proteins, particularly large protein complexes and assemblies in recent years. A key challenge in cryo-EM data analysis is to automatically reconstruct accurate protein structures from cryo-EM density maps. In this review, we briefly overview various deep learning methods for building protein structures from cryo-EM density maps, analyze their impact, and discuss the challenges of preparing high-quality data sets for training deep learning models. Looking into the future, more advanced deep learning models of effectively integrating cryo-EM data with other sources of complementary data such as protein sequences and AlphaFold-predicted structures need to be developed to further advance the field.

Best subset of groups selection (BSGS) is the process of selecting a small part of non-overlapping groups to achieve the best interpretability on the response variable. It has attracted increasing attention and has far-reaching applications in practice. However, due to the computational intractability of BSGS in high-dimensional settings, developing efficient algorithms for solving BSGS remains a research hotspot. In this paper,we propose a group-splicing algorithm that iteratively detects the relevant groups and excludes the irrelevant ones. Moreover, coupled with a novel group information criterion, we develop an adaptive algorithm to determine the optimal model size. Under mild conditions, it is certifiable that our algorithm can identify the optimal subset of groups in polynomial time with high probability. Finally, we demonstrate the efficiency and accuracy of our methods by comparing them with several state-of-the-art algorithms on both synthetic and real-world datasets.

The thin-file borrowers are customers for whom a creditworthiness assessment is uncertain due to their lack of credit history; many researchers have used borrowers' relationships and interactions networks in the form of graphs as an alternative data source to address this. Incorporating network data is traditionally made by hand-crafted feature engineering, and lately, the graph neural network has emerged as an alternative, but it still does not improve over the traditional method's performance. Here we introduce a framework to improve credit scoring models by blending several Graph Representation Learning methods: feature engineering, graph embeddings, and graph neural networks. We stacked their outputs to produce a single score in this approach. We validated this framework using a unique multi-source dataset that characterizes the relationships and credit history for the entire population of a Latin American country, applying it to credit risk models, application, and behavior, targeting both individuals and companies. Our results show that the graph representation learning methods should be used as complements, and these should not be seen as self-sufficient methods as is currently done. In terms of AUC and KS, we enhance the statistical performance, outperforming traditional methods. In Corporate lending, where the gain is much higher, it confirms that evaluating an unbanked company cannot solely consider its features. The business ecosystem where these firms interact with their owners, suppliers, customers, and other companies provides novel knowledge that enables financial institutions to enhance their creditworthiness assessment. Our results let us know when and which group to use graph data and what effects on performance to expect. They also show the enormous value of graph data on the unbanked credit scoring problem, principally to help companies' banking.

\cite{rohe2016co} proposed Stochastic co-Blockmodel (ScBM) as a tool for detecting community structure of binary directed graph data in network studies. However, ScBM completely ignores node weight, and is unable to explain the block structure of directed weighted network which appears in various areas, such as biology, sociology, physiology and computer science. Here, to model directed weighted network, we introduce a Directed Distribution-Free model by releasing ScBM's distribution restriction. We also build an extension of the proposed model by considering variation of node degree. Our models do not require a specific distribution on generating elements of adjacency matrix but only a block structure on the expected adjacency matrix. Spectral algorithms with theoretical guarantee on consistent estimation of node label are presented to identify communities. Our proposed methods are illustrated by simulated and empirical examples.

In contrast to single-objective optimization (SOO), multi-objective optimization (MOO) requires an optimizer to find the Pareto frontier, a subset of feasible solutions that are not dominated by other feasible solutions. In this paper, we propose LaMOO, a novel multi-objective optimizer that learns a model from observed samples to partition the search space and then focus on promising regions that are likely to contain a subset of the Pareto frontier. The partitioning is based on the dominance number, which measures "how close" a data point is to the Pareto frontier among existing samples. To account for possible partition errors due to limited samples and model mismatch, we leverage Monte Carlo Tree Search (MCTS) to exploit promising regions while exploring suboptimal regions that may turn out to contain good solutions later. Theoretically, we prove the efficacy of learning space partitioning via LaMOO under certain assumptions. Empirically, on the HyperVolume (HV) benchmark, a popular MOO metric, LaMOO substantially outperforms strong baselines on multiple real-world MOO tasks, by up to 225% in sample efficiency for neural architecture search on Nasbench201, and up to 10% for molecular design.

Hypercomplex neural networks have proven to reduce the overall number of parameters while ensuring valuable performance by leveraging the properties of Clifford algebras. Recently, hypercomplex linear layers have been further improved by involving efficient parameterized Kronecker products. In this paper, we define the parameterization of hypercomplex convolutional layers and introduce the family of parameterized hypercomplex neural networks (PHNNs) that are lightweight and efficient large-scale models. Our method grasps the convolution rules and the filter organization directly from data without requiring a rigidly predefined domain structure to follow. PHNNs are flexible to operate in any user-defined or tuned domain, from 1D to $n$D regardless of whether the algebra rules are preset. Such a malleability allows processing multidimensional inputs in their natural domain without annexing further dimensions, as done, instead, in quaternion neural networks for 3D inputs like color images. As a result, the proposed family of PHNNs operates with $1/n$ free parameters as regards its analog in the real domain. We demonstrate the versatility of this approach to multiple domains of application by performing experiments on various image datasets as well as audio datasets in which our method outperforms real and quaternion-valued counterparts. Full code is available at: https://github.com/eleGAN23/HyperNets.

The CP decomposition for high dimensional non-orthogonal spiked tensors is an important problem with broad applications across many disciplines. However, previous works with theoretical guarantee typically assume restrictive incoherence conditions on the basis vectors for the CP components. In this paper, we propose new computationally efficient composite PCA and concurrent orthogonalization algorithms for tensor CP decomposition with theoretical guarantees under mild incoherence conditions. The composite PCA applies the principal component or singular value decompositions twice, first to a matrix unfolding of the tensor data to obtain singular vectors and then to the matrix folding of the singular vectors obtained in the first step. It can be used as an initialization for any iterative optimization schemes for the tensor CP decomposition. The concurrent orthogonalization algorithm iteratively estimates the basis vector in each mode of the tensor by simultaneously applying projections to the orthogonal complements of the spaces generated by other CP components in other modes. It is designed to improve the alternating least squares estimator and other forms of the high order orthogonal iteration for tensors with low or moderately high CP ranks, and it is guaranteed to converge rapidly when the error of any given initial estimator is bounded by a small constant. Our theoretical investigation provides estimation accuracy and convergence rates for the two proposed algorithms. Both proposed algorithms are applicable to deterministic tensor, its noisy version, and the order-$2K$ covariance tensor of order-$K$ tensor data in a factor model with uncorrelated factors. Our implementations on synthetic data demonstrate significant practical superiority of our approach over existing methods.

An effective weighting scheme for training samples is essential for learning tasks. Numerous weighting schemes have been proposed. Some schemes take the easy-first mode, whereas some others take the hard-first one. Naturally, an interesting yet realistic question is raised. Which samples should be learned first given a new learning task, easy or hard? To answer this question, both theoretical analyses and experimental verification are conducted. First, a general optimized objective function is proposed, revealing the relationship between the difficulty distribution and the difficulty-based sample weights. Second, on the basis of the optimized objective function, theoretical answers are obtained. Besides the easy-first and hard-first modes, there are two other priority modes, namely, medium-first and two-ends-first. The prior mode does not necessarily remain unchanged during the training process. Third, an effective and universal solution is proposed to select the optimal priority mode when there is no prior knowledge or theoretical clues. The four modes, namely, easy/medium/hard/two-ends-first, can be flexibly switched in the proposed solution. Fourth, a wide range of experiments is conducted under various scenarios to further compare the weighting schemes in different modes. On the basis of these works, reasonable and comprehensive answers are obtained. Factors including the distribution of samples' learning difficulties and the validation data determine which samples should be learned first in a learning task.

The success of neural networks over the past decade has established them as effective models for many relevant data generating processes. Statistical theory on neural networks indicates graceful scaling of sample complexity. For example, Joen & Van Roy (arXiv:2203.00246) demonstrate that, when data is generated by a ReLU teacher network with $W$ parameters, an optimal learner needs only $\tilde{O}(W/\epsilon)$ samples to attain expected error $\epsilon$. However, existing computational theory suggests that, even for single-hidden-layer teacher networks, to attain small error for all such teacher networks, the computation required to achieve this sample complexity is intractable. In this work, we fit single-hidden-layer neural networks to data generated by single-hidden-layer ReLU teacher networks with parameters drawn from a natural distribution. We demonstrate that stochastic gradient descent (SGD) with automated width selection attains small expected error with a number of samples and total number of queries both nearly linear in the input dimension and width. This suggests that SGD nearly achieves the information-theoretic sample complexity bounds of Joen & Van Roy (arXiv:2203.00246) in a computationally efficient manner. An important difference between our positive empirical results and the negative theoretical results is that the latter address worst-case error of deterministic algorithms, while our analysis centers on expected error of a stochastic algorithm.

Since their introduction, graph attention networks achieved outstanding results in graph representation learning tasks. However, these networks consider only pairwise relationships among nodes and then they are not able to fully exploit higher-order interactions present in many real world data-sets. In this paper, we introduce Cell Attention Networks (CANs), a neural architecture operating on data defined over the vertices of a graph, representing the graph as the 1-skeleton of a cell complex introduced to capture higher order interactions. In particular, we exploit the lower and upper neighborhoods, as encoded in the cell complex, to design two independent masked self-attention mechanisms, thus generalizing the conventional graph attention strategy. The approach used in CANs is hierarchical and it incorporates the following steps: i) a lifting algorithm that learns {\it edge features} from {\it node features}; ii) a cell attention mechanism to find the optimal combination of edge features over both lower and upper neighbors; iii) a hierarchical {\it edge pooling} mechanism to extract a compact meaningful set of features. The experimental results show that CAN is a low complexity strategy that compares favorably with state of the art results on graph-based learning tasks.

Homomorphic sensing is a recent algebraic-geometric framework that studies the unique recovery of points in a linear subspace from their images under a given collection of linear maps. It has been successful in interpreting such a recovery in the case of permutations composed by coordinate projections, an important instance in applications known as unlabeled sensing, which models data that are out of order and have missing values. In this paper, we provide tighter and simpler conditions that guarantee the unique recovery for the single-subspace case, extend the result to the case of a subspace arrangement, and show that the unique recovery in a single subspace is locally stable under noise. We specialize our results to several examples of homomorphic sensing such as real phase retrieval and unlabeled sensing. In so doing, in a unified way, we obtain conditions that guarantee the unique recovery for those examples, typically known via diverse techniques in the literature, as well as novel conditions for sparse and unsigned versions of unlabeled sensing. Similarly, our noise result also implies that the unique recovery in unlabeled sensing is locally stable.

In real scenarios, state observations that an agent observes may contain measurement errors or adversarial noises, misleading the agent to take suboptimal actions or even collapse while training. In this paper, we study the training robustness of distributional Reinforcement Learning~(RL), a class of state-of-the-art methods that estimate the whole distribution, as opposed to only the expectation, of the total return. Firstly, we validate the contraction of distributional Bellman operators in the State-Noisy Markov Decision Process~(SN-MDP), a typical tabular case that incorporates both random and adversarial state observation noises. In the noisy setting with function approximation, we then analyze the vulnerability of least squared loss in expectation-based RL with either linear or nonlinear function approximation. By contrast, we theoretically characterize the bounded gradient norm of distributional RL loss based on the categorical parameterization equipped with the Kullback-Leibler~(KL) divergence. The resulting stable gradients while the optimization in distributional RL accounts for its better training robustness against state observation noises. Finally, extensive experiments on the suite of environments verified that distributional RL is less vulnerable against both random and adversarial noisy state observations compared with its expectation-based counterpart.

We study the offline reinforcement learning (RL) in the face of unmeasured confounders. Due to the lack of online interaction with the environment, offline RL is facing the following two significant challenges: (i) the agent may be confounded by the unobserved state variables; (ii) the offline data collected a prior does not provide sufficient coverage for the environment. To tackle the above challenges, we study the policy learning in the confounded MDPs with the aid of instrumental variables. Specifically, we first establish value function (VF)-based and marginalized importance sampling (MIS)-based identification results for the expected total reward in the confounded MDPs. Then by leveraging pessimism and our identification results, we propose various policy learning methods with the finite-sample suboptimality guarantee of finding the optimal in-class policy under minimal data coverage and modeling assumptions. Lastly, our extensive theoretical investigations and one numerical study motivated by the kidney transplantation demonstrate the promising performance of the proposed methods.

Recent advances in unsupervised representation learning significantly improved the sample efficiency of training Reinforcement Learning policies in simulated environments. However, similar gains have not yet been seen for real-robot reinforcement learning. In this work, we focus on enabling data-efficient real-robot learning from pixels. We present Contrastive Pre-training and Data Augmentation for Efficient Robotic Learning (CoDER), a method that utilizes data augmentation and unsupervised learning to achieve sample-efficient training of real-robot arm policies from sparse rewards. While contrastive pre-training, data augmentation, demonstrations, and reinforcement learning are alone insufficient for efficient learning, our main contribution is showing that the combination of these disparate techniques results in a simple yet data-efficient method. We show that, given only 10 demonstrations, a single robotic arm can learn sparse-reward manipulation policies from pixels, such as reaching, picking, moving, pulling a large object, flipping a switch, and opening a drawer in just 30 minutes of mean real-world training time. We include videos and code on the project website: https://sites.google.com/view/efficient-robotic-manipulation/home

Principal Component Analysis (PCA) minimizes the reconstruction error given a class of linear models of fixed component dimensionality. Probabilistic PCA adds a probabilistic structure by learning the probability distribution of the PCA latent space weights, thus creating a generative model. Autoencoders (AE) minimize the reconstruction error in a class of nonlinear models of fixed latent space dimensionality and outperform PCA at fixed dimensionality. Here, we introduce the Probabilistic Autoencoder (PAE) that learns the probability distribution of the AE latent space weights using a normalizing flow (NF). The PAE is fast and easy to train and achieves small reconstruction errors, high sample quality, and good performance in downstream tasks. We compare the PAE to Variational AE (VAE), showing that the PAE trains faster, reaches a lower reconstruction error, and produces good sample quality without requiring special tuning parameters or training procedures. We further demonstrate that the PAE is a powerful model for performing the downstream tasks of probabilistic image reconstruction in the context of Bayesian inference of inverse problems for inpainting and denoising applications. Finally, we identify latent space density from NF as a promising outlier detection metric.

We present a novel collection of news articles originating from fake and real news media sources for the analysis and prediction of news virality. Unlike existing fake news datasets which either contain claims or news article headline and body, in this collection each article is supported with a Facebook engagement count which we consider as an indicator of the article virality. In addition we also provide the article description and thumbnail image with which the article was shared on Facebook. These images were automatically annotated with object tags and color attributes. Using cloud based vision analysis tools, thumbnail images were also analyzed for faces and detected faces were annotated with facial attributes. We empirically investigate the use of this collection on an example task of article virality prediction.

Audio segmentation and sound event detection are crucial topics in machine listening that aim to detect acoustic classes and their respective boundaries. It is useful for audio-content analysis, speech recognition, audio-indexing, and music information retrieval. In recent years, most research articles adopt segmentation-by-classification. This technique divides audio into small frames and individually performs classification on these frames. In this paper, we present a novel approach called You Only Hear Once (YOHO), which is inspired by the YOLO algorithm popularly adopted in Computer Vision. We convert the detection of acoustic boundaries into a regression problem instead of frame-based classification. This is done by having separate output neurons to detect the presence of an audio class and predict its start and end points. The relative improvement for F-measure of YOHO, compared to the state-of-the-art Convolutional Recurrent Neural Network, ranged from 1% to 6% across multiple datasets for audio segmentation and sound event detection. As the output of YOHO is more end-to-end and has fewer neurons to predict, the speed of inference is at least 6 times faster than segmentation-by-classification. In addition, as this approach predicts acoustic boundaries directly, the post-processing and smoothing is about 7 times faster.

Gas network planning optimization under emission constraints prioritizes gas supply with the least CO$_2$ intensity. As this problem includes complex physical laws of gas flow, standard optimization solvers cannot guarantee convergence to a feasible solution. To address this issue, we develop an input-convex neural network (ICNN) aided optimization routine which incorporates a set of trained ICNNs approximating the gas flow equations with high precision. Numerical tests on the Belgium gas network demonstrate that the ICNN-aided optimization dominates non-convex and relaxation-based solvers, with larger optimality gains pertaining to stricter emission targets. Moreover, whenever the non-convex solver fails, the ICNN-aided optimization provides a feasible solution to network planning.

Processing-in-memory (PIM), an increasingly studied neuromorphic hardware, promises orders of energy and throughput improvements for deep learning inference. Leveraging the massively parallel and efficient analog computing inside memories, PIM circumvents the bottlenecks of data movements in conventional digital hardware. However, an extra quantization step (i.e. PIM quantization), typically with limited resolution due to hardware constraints, is required to convert the analog computing results into digital domain. Meanwhile, non-ideal effects extensively exist in PIM quantization because of the imperfect analog-to-digital interface, which further compromises the inference accuracy. In this paper, we propose a method for training quantized networks to incorporate PIM quantization, which is ubiquitous to all PIM systems. Specifically, we propose a PIM quantization aware training (PIM-QAT) algorithm, and introduce rescaling techniques during backward and forward propagation by analyzing the training dynamics to facilitate training convergence. We also propose two techniques, namely batch normalization (BN) calibration and adjusted precision training, to suppress the adverse effects of non-ideal linearity and stochastic thermal noise involved in real PIM chips. Our method is validated on three mainstream PIM decomposition schemes, and physically on a prototype chip. Comparing with directly deploying conventionally trained quantized model on PIM systems, which does not take into account this extra quantization step and thus fails, our method provides significant improvement. It also achieves comparable inference accuracy on PIM systems as that of conventionally quantized models on digital hardware, across CIFAR10 and CIFAR100 datasets using various network depths for the most popular network topology.

Decentralized learning has shown great promise for cooperative multi-agent reinforcement learning (MARL). However, non-stationarity remains a significant challenge in decentralized learning. In the paper, we tackle the non-stationarity problem in the simplest and fundamental way and propose \textit{multi-agent alternate Q-learning} (MA2QL), where agents take turns to update their Q-functions by Q-learning. MA2QL is a \textit{minimalist} approach to fully decentralized cooperative MARL but is theoretically grounded. We prove that when each agent guarantees a $\varepsilon$-convergence at each turn, their joint policy converges to a Nash equilibrium. In practice, MA2QL only requires minimal changes to independent Q-learning (IQL). We empirically evaluate MA2QL on a variety of cooperative multi-agent tasks. Results show MA2QL consistently outperforms IQL, which verifies the effectiveness of MA2QL, despite such minimal changes.

Personalized federated learning allows for clients in a distributed system to train a neural network tailored to their unique local data while leveraging information at other clients. However, clients' models are vulnerable to attacks during both the training and testing phases. In this paper we address the issue of adversarial clients crafting evasion attacks at test time to deceive other clients. For example, adversaries may aim to deceive spam filters and recommendation systems trained with personalized federated learning for monetary gain. The adversarial clients have varying degrees of personalization based on the method of distributed learning, leading to a "grey-box" situation. We are the first to characterize the transferability of such internal evasion attacks for different learning methods and analyze the trade-off between model accuracy and robustness depending on the degree of personalization and similarities in client data. We introduce a defense mechanism, pFedDef, that performs personalized federated adversarial training while respecting resource limitations at clients that inhibit adversarial training. Overall, pFedDef increases relative grey-box adversarial robustness by 62% compared to federated adversarial training and performs well even under limited system resources.

We propose a simple modification to standard ResNet architectures--L2 regularization over feature space--that substantially improves out-of-distribution (OoD) performance on the previously proposed Deep Deterministic Uncertainty (DDU) benchmark. This change also induces early Neural Collapse (NC), which we show is an effect under which better OoD performance is more probable. Our method achieves comparable or superior OoD detection scores and classification accuracy in a small fraction of the training time of the benchmark. Additionally, it substantially improves worst case OoD performance over multiple, randomly initialized models. Though we do not suggest that NC is the sole mechanism or comprehensive explanation for OoD behaviour in deep neural networks (DNN), we believe NC's simple mathematical and geometric structure can provide an framework for analysis of this complex phenomenon in future work.

Hybrid modeling combining data-driven techniques and numerical methods is an emerging and promising research direction for efficient climate simulation. However, previous works lack practical platforms, making developing hybrid modeling a challenging programming problem. Furthermore, the lack of standard data sets and evaluation metrics may hamper researchers from comprehensively comparing various algorithms under a uniform condition. To address these problems, we propose a framework called NeuroClim for hybrid modeling under the real-world scenario, a basic setting to simulate the real climate that we live in. NeuroClim consists of three parts: (1) Platform. We develop a user-friendly platform NeuroGCM for efficiently developing hybrid modeling in climate simulation. (2) Dataset. We provide an open-source dataset for data-driven methods in hybrid modeling. We investigate the characteristics of the data, i.e., heterogeneity and stiffness, which reveals the difficulty of regressing climate simulation data; (3) Metrics. We propose a methodology for quantitatively evaluating hybrid modeling, including the approximation ability of machine learning models and the stability during simulation. We believe that NeuroClim allows researchers to work without high level of climate-related expertise and focus only on machine learning algorithm design, which will accelerate hybrid modeling research in the AI-Climate intersection. The codes and data are released at https://github.com/x-w19/NeuroClim.

This paper provides fascinating connections between several mathematical problems which lie on the intersection of several mathematics subjects, namely algebraic geometry, approximation theory, complex-harmonic analysis and high dimensional data science. Modern techniques in algebraic geometry, approximation theory, computational harmonic analysis and extensions develop the first of its kind, a unified framework which allows for a simultaneous study of labeled and unlabeled near alignment data problems in of $\mathbb R^D$ with the near isometry extension problem for discrete and non-discrete subsets of $\mathbb R^D$ with certain geometries. In addition, the paper surveys related work on clustering, dimension reduction, manifold learning, vision as well as minimal energy partitions, discrepancy and min-max optimization. Numerous open problems are given.

Two aspects of neural networks that have been extensively studied in the recent literature are their function approximation properties and their training by gradient descent methods. The approximation problem seeks accurate approximations with a minimal number of weights. In most of the current literature these weights are fully or partially hand-crafted, showing the capabilities of neural networks but not necessarily their practical performance. In contrast, optimization theory for neural networks heavily relies on an abundance of weights in over-parametrized regimes. This paper balances these two demands and provides an approximation result for shallow networks in $1d$ with non-convex weight optimization by gradient descent. We consider finite width networks and infinite sample limits, which is the typical setup in approximation theory. Technically, this problem is not over-parametrized, however, some form of redundancy reappears as a loss in approximation rate compared to best possible rates.

There has been much recent research on human activity re\-cog\-ni\-tion (HAR), due to the proliferation of wearable sensors in watches and phones, and the advances of deep learning methods, which avoid the need to manually extract features from raw sensor signals. A significant disadvantage of deep learning applied to HAR is the need for manually labelled training data, which is especially difficult to obtain for HAR datasets. Progress is starting to be made in the unsupervised setting, in the form of deep HAR clustering models, which can assign labels to data without having been given any labels to train on, but there are problems with evaluating deep HAR clustering models, which makes assessing the field and devising new methods difficult. In this paper, we highlight several distinct problems with how deep HAR clustering models are evaluated, describing these problems in detail and conducting careful experiments to explicate the effect that they can have on results. We then discuss solutions to these problems, and suggest standard evaluation settings for future deep HAR clustering models. Additionally, we present a new deep clustering model for HAR. When tested under our proposed settings, our model performs better than (or on par with) existing models, while also being more efficient and better able to scale to more complex datasets by avoiding the need for an autoencoder.

The problem of inferring the direct causal parents of a response variable among a large set of explanatory variables is of high practical importance in many disciplines. However, established approaches often scale at least exponentially with the number of explanatory variables, are difficult to extend to nonlinear relationships, and are difficult to extend to cyclic data. Inspired by {\em Debiased} machine learning methods, we study a one-vs.-the-rest feature selection approach to discover the direct causal parent of the response. We propose an algorithm that works for purely observational data while also offering theoretical guarantees, including the case of partially nonlinear relationships possibly under the presence of cycles. As it requires only one estimation for each variable, our approach is applicable even to large graphs. We demonstrate significant improvements compared to established approaches.

In this work, we present our journey to revolutionize the personalized recommendation engine through end-to-end learning from raw user actions. We encode user's long-term interest in Pinner- Former, a user embedding optimized for long-term future actions via a new dense all-action loss, and capture user's short-term intention by directly learning from the real-time action sequences. We conducted both offline and online experiments to validate the performance of the new model architecture, and also address the challenge of serving such a complex model using mixed CPU/GPU setup in production. The proposed system has been deployed in production at Pinterest and has delivered significant online gains across organic and Ads applications.

Deep learning models have shown impressive results in a variety of time series forecasting tasks, where modeling the conditional distribution of the future given the past is the essence. However, when this conditional distribution is non-stationary, it poses challenges for these models to learn consistently and to predict accurately. In this work, we propose a new method to model non-stationary conditional distributions over time by clearly decoupling stationary conditional distribution modeling from non-stationary dynamics modeling. Our method is based on a Bayesian dynamic model that can adapt to conditional distribution changes and a deep conditional distribution model that can handle large multivariate time series using a factorized output space. Our experimental results on synthetic and popular public datasets show that our model can adapt to non-stationary time series better than state-of-the-art deep learning solutions.

While reinforcement learning (RL) methods that learn an internal model of the environment have the potential to be more sample efficient than their model-free counterparts, learning to model raw observations from high dimensional sensors can be challenging. Prior work has addressed this challenge by learning low-dimensional representation of observations through auxiliary objectives, such as reconstruction or value prediction. However, the alignment between these auxiliary objectives and the RL objective is often unclear. In this work, we propose a single objective which jointly optimizes a latent-space model and policy to achieve high returns while remaining self-consistent. This objective is a lower bound on expected returns. Unlike prior bounds for model-based RL on policy exploration or model guarantees, our bound is directly on the overall RL objective. We demonstrate that the resulting algorithm matches or improves the sample-efficiency of the best prior model-based and model-free RL methods. While such sample efficient methods typically are computationally demanding, our method attains the performance of SAC in about 50\% less wall-clock time.

Electric vehicles (EVs) play critical roles in autonomous mobility-on-demand (AMoD) systems, but their unique charging patterns increase the model uncertainties in AMoD systems (e.g. state transition probability). Since there usually exists a mismatch between the training and test (true) environments, incorporating model uncertainty into system design is of critical importance in real-world applications. However, model uncertainties have not been considered explicitly in EV AMoD system rebalancing by existing literature yet and remain an urgent and challenging task. In this work, we design a robust and constrained multi-agent reinforcement learning (MARL) framework with transition kernel uncertainty for the EV rebalancing and charging problem. We then propose a robust and constrained MARL algorithm (ROCOMA) that trains a robust EV rebalancing policy to balance the supply-demand ratio and the charging utilization rate across the whole city under state transition uncertainty. Experiments show that the ROCOMA can learn an effective and robust rebalancing policy. It outperforms non-robust MARL methods when there are model uncertainties. It increases the system fairness by 19.6% and decreases the rebalancing costs by 75.8%.

Human texture perception is a weighted average of multi-sensory inputs: visual and tactile. While the visual sensing mechanism extracts global features, the tactile mechanism complements it by extracting local features. The lack of coupled visuotactile datasets in the literature is a challenge for studying multimodal fusion strategies analogous to human texture perception. This paper presents a visual dataset that augments an existing tactile dataset. We propose a novel deep fusion architecture that fuses visual and tactile data using four types of fusion strategies: summation, concatenation, max-pooling, and attention. Our model shows significant performance improvements (97.22%) in surface roughness classification accuracy over tactile only (SVM - 92.60%) and visual only (FENet-50 - 85.01%) architectures. Among the several fusion techniques, attention-guided architecture results in better classification accuracy. Our study shows that analogous to human texture perception, the proposed model chooses a weighted combination of the two modalities (visual and tactile), thus resulting in higher surface roughness classification accuracy; and it chooses to maximize the weightage of the tactile modality where the visual modality fails and vice-versa.

Using information-theoretic principles, we consider the generalization error (gen-error) of iterative semi-supervised learning (SSL) algorithms that iteratively generate pseudo-labels for a large amount of unlabelled data to progressively refine the model parameters. In contrast to most previous works that {\em bound} the gen-error, we provide an {\em exact} expression for the gen-error and particularize it to the binary Gaussian mixture model. Our theoretical results suggest that when the class conditional variances are not too large, the gen-error decreases with the number of iterations, but quickly saturates. On the flip side, if the class conditional variances (and so amount of overlap between the classes) are large, the gen-error increases with the number of iterations. To mitigate this undesirable effect, we show that regularization can reduce the gen-error. The theoretical results are corroborated by extensive experiments on the MNIST and CIFAR datasets in which we notice that for easy-to-distinguish classes, the gen-error improves after several pseudo-labelling iterations, but saturates afterwards, and for more difficult-to-distinguish classes, regularization improves the generalization performance.

We consider the problem of learning the optimal threshold policy for control problems. Threshold policies make control decisions by evaluating whether an element of the system state exceeds a certain threshold, whose value is determined by other elements of the system state. By leveraging the monotone property of threshold policies, we prove that their policy gradients have a surprisingly simple expression. We use this simple expression to build an off-policy actor-critic algorithm for learning the optimal threshold policy. Simulation results show that our policy significantly outperforms other reinforcement learning algorithms due to its ability to exploit the monotone property. In addition, we show that the Whittle index, a powerful tool for restless multi-armed bandit problems, is equivalent to the optimal threshold policy for an alternative problem. This observation leads to a simple algorithm that finds the Whittle index by learning the optimal threshold policy in the alternative problem. Simulation results show that our algorithm learns the Whittle index much faster than several recent studies that learn the Whittle index through indirect means.

Flocking control is a significant problem in multi-agent systems such as multi-agent unmanned aerial vehicles and multi-agent autonomous underwater vehicles, which enhances the cooperativity and safety of agents. In contrast to traditional methods, multi-agent reinforcement learning (MARL) solves the problem of flocking control more flexibly. However, methods based on MARL suffer from sample inefficiency, since they require a huge number of experiences to be collected from interactions between agents and the environment. We propose a novel method Pretraining with Demonstrations for MARL (PwD-MARL), which can utilize non-expert demonstrations collected in advance with traditional methods to pretrain agents. During the process of pretraining, agents learn policies from demonstrations by MARL and behavior cloning simultaneously, and are prevented from overfitting demonstrations. By pretraining with non-expert demonstrations, PwD-MARL improves sample efficiency in the process of online MARL with a warm start. Experiments show that PwD-MARL improves sample efficiency and policy performance in the problem of flocking control, even with bad or few demonstrations.

Global Navigation Satellite Systems typically perform poorly in urban environments, where the likelihood of line-of-sight conditions between the devices and the satellites is low, and thus alternative localization methods are required for good accuracy. We present LocUNet: A convolutional, end-to-end trained neural network for the localization task, able to estimate the position of a user from the received signal strength (RSS) from a small number of Base Stations (BSs). In the proposed method, the user to be localized simply reports the measured RSS to a central processing unit, which may be located in the cloud. Using estimations of pathloss radio maps of the BSs and the RSS measurements, LocUNet can localize users with state-of-the-art accuracy and enjoys high robustness to inaccuracies in the estimations of radio maps. The proposed method does not require pre-sampling of new environments and is suitable for real-time applications. Moreover, two novel datasets that allow for numerical evaluations of RSS and ToA methods in realistic urban environments are presented and made publicly available for the research community. By using these datasets, we also provide a fair comparison of state-of-the-art RSS and ToA-based methods in the dense urban scenario and show numerically that LocUNet outperforms all the compared methods.

A large body of work shows that machine learning (ML) models can leak sensitive or confidential information about their training data. Recently, leakage due to distribution inference (or property inference) attacks is gaining attention. In this attack, the goal of an adversary is to infer distributional information about the training data. So far, research on distribution inference has focused on demonstrating successful attacks, with little attention given to identifying the potential causes of the leakage and to proposing mitigations. To bridge this gap, as our main contribution, we theoretically and empirically analyze the sources of information leakage that allows an adversary to perpetrate distribution inference attacks. We identify three sources of leakage: (1) memorizing specific information about the $\mathbb{E}[Y|X]$ (expected label given the feature values) of interest to the adversary, (2) wrong inductive bias of the model, and (3) finiteness of the training data. Next, based on our analysis, we propose principled mitigation techniques against distribution inference attacks. Specifically, we demonstrate that causal learning techniques are more resilient to a particular type of distribution inference risk termed distributional membership inference than associative learning methods. And lastly, we present a formalization of distribution inference that allows for reasoning about more general adversaries than was previously possible.

In this paper, we study the problem of learning a repertoire of low-level skills from raw images that can be sequenced to complete long-horizon visuomotor tasks. Reinforcement learning (RL) is a promising approach for acquiring short-horizon skills autonomously. However, the focus of RL algorithms has largely been on the success of those individual skills, more so than learning and grounding a large repertoire of skills that can be sequenced to complete extended multi-stage tasks. The latter demands robustness and persistence, as errors in skills can compound over time, and may require the robot to have a number of primitive skills in its repertoire, rather than just one. To this end, we introduce EMBER, a model-based RL method for learning primitive skills that are suitable for completing long-horizon visuomotor tasks. EMBER learns and plans using a learned model, critic, and success classifier, where the success classifier serves both as a reward function for RL and as a grounding mechanism to continuously detect if the robot should retry a skill when unsuccessful or under perturbations. Further, the learned model is task-agnostic and trained using data from all skills, enabling the robot to efficiently learn a number of distinct primitives. These visuomotor primitive skills and their associated pre- and post-conditions can then be directly combined with off-the-shelf symbolic planners to complete long-horizon tasks. On a Franka Emika robot arm, we find that EMBER enables the robot to complete three long-horizon visuomotor tasks at 85% success rate, such as organizing an office desk, a file cabinet, and drawers, which require sequencing up to 12 skills, involve 14 unique learned primitives, and demand generalization to novel objects.

Resting state fMRI is an imaging modality which reveals brain activity localization through signal changes, in what is known as Resting State Networks (RSNs). This technique is gaining popularity in neurosurgical pre-planning to visualize the functional regions and assess regional activity. Labeling of rs-fMRI networks require subject-matter expertise and is time consuming, creating a need for an automated classification algorithm. While the impact of AI in medical diagnosis has shown great progress; deploying and maintaining these in a clinical setting is an unmet need. We propose an end-to-end reproducible pipeline which incorporates image processing of rs-fMRI in a cloud-based workflow while using deep learning to automate the classification of RSNs. We have architected a reproducible Azure Machine Learning cloud-based medical imaging concept pipeline for fMRI analysis integrating the popular FMRIB Software Library (FSL) toolkit. To demonstrate a clinical application using a large dataset, we compare three neural network architectures for classification of deeper RSNs derived from processed rs-fMRI. The three algorithms are: an MLP, a 2D projection-based CNN, and a fully 3D CNN classification networks. Each of the net-works was trained on the rs-fMRI back-projected independent components giving >98% accuracy for each classification method.

We address the problem of uncertainty calibration and introduce a novel calibration method, Parametrized Temperature Scaling (PTS). Standard deep neural networks typically yield uncalibrated predictions, which can be transformed into calibrated confidence scores using post-hoc calibration methods. In this contribution, we demonstrate that the performance of accuracy-preserving state-of-the-art post-hoc calibrators is limited by their intrinsic expressive power. We generalize temperature scaling by computing prediction-specific temperatures, parameterized by a neural network. We show with extensive experiments that our novel accuracy-preserving approach consistently outperforms existing algorithms across a large number of model architectures, datasets and metrics.

Algorithmic decision-making in societal contexts, such as retail pricing, loan administration, recommendations on online platforms, etc., often involves experimentation with decisions for the sake of learning, which results in perceptions of unfairness among people impacted by these decisions. It is hence necessary to embed appropriate notions of fairness in such decision-making processes. The goal of this paper is to highlight the rich interface between temporal notions of fairness and online decision-making through a novel meta-objective of ensuring fairness at the time of decision. Given some arbitrary comparative fairness notion for static decision-making (e.g., students should pay at most 90% of the general adult price), a corresponding online decision-making algorithm satisfies fairness at the time of decision if the said notion of fairness is satisfied for any entity receiving a decision in comparison to all the past decisions. We show that this basic requirement introduces new methodological challenges in online decision-making. We illustrate the novel approaches necessary to address these challenges in the context of stochastic convex optimization with bandit feedback under a comparative fairness constraint that imposes lower bounds on the decisions received by entities depending on the decisions received by everyone in the past. The paper showcases novel research opportunities in online decision-making stemming from temporal fairness concerns.

Distributional reinforcement learning~(RL) is a class of state-of-the-art algorithms that estimate the whole distribution of the total return rather than only its expectation. Despite the remarkable performance of distributional RL, a theoretical understanding of its advantages over expectation-based RL remains elusive. In this paper, we attribute the superiority of distributional RL to its regularization effect in terms of the value distribution information regardless of its expectation. Firstly, by leverage of a variant of the gross error model in robust statistics, we decompose the value distribution into its expectation and the remaining distribution part. As such, the extra benefit of distributional RL compared with expectation-based RL is mainly interpreted as the impact of a \textit{risk-sensitive entropy regularization} within the Neural Fitted Z-Iteration framework. Meanwhile, we establish a bridge between the risk-sensitive entropy regularization of distributional RL and the vanilla entropy in maximum entropy RL, focusing specifically on actor-critic algorithms. It reveals that distributional RL induces a corrected reward function and thus promotes a risk-sensitive exploration against the intrinsic uncertainty of the environment. Finally, extensive experiments corroborate the role of the regularization effect of distributional RL and uncover mutual impacts of different entropy regularization. Our research paves a way towards better interpreting the efficacy of distributional RL algorithms, especially through the lens of regularization.

We propose a new approach, Knowledge Distillation using Optimal Transport (KNOT), to distill the natural language semantic knowledge from multiple teacher networks to a student network. KNOT aims to train a (global) student model by learning to minimize the optimal transport cost of its assigned probability distribution over the labels to the weighted sum of probabilities predicted by the (local) teacher models, under the constraints, that the student model does not have access to teacher models' parameters or training data. To evaluate the quality of knowledge transfer, we introduce a new metric, Semantic Distance (SD), that measures semantic closeness between the predicted and ground truth label distributions. The proposed method shows improvements in the global model's SD performance over the baseline across three NLP tasks while performing on par with Entropy-based distillation on standard accuracy and F1 metrics. The implementation pertaining to this work is publicly available at: https://github.com/declare-lab/KNOT.

Noise and uncertainty are usually the enemy of machine learning, noise in training data leads to uncertainty and inaccuracy in the predictions. However, we develop a machine learning architecture that extracts crucial information out of the noise itself to improve the predictions. The phenomenology computes and then utilizes uncertainty in one target variable to predict a second target variable. We apply this formalism to PbZr$_{0.7}$Sn$_{0.3}$O$_{3}$ crystal, using the uncertainty in dielectric constant to extrapolate heat capacity, correctly predicting a phase transition that otherwise cannot be extrapolated. For the second example -- single-particle diffraction of droplets -- we utilize the particle count together with its uncertainty to extrapolate the ground truth diffraction amplitude, delivering better predictions than when we utilize only the particle count. Our generic formalism enables the exploitation of uncertainty in machine learning, which has a broad range of applications in the physical sciences and beyond.

Deep Neural Networks (DNNs) have become an essential component in many application domains including web-based services. A variety of these services require high throughput and (close to) real-time features, for instance, to respond or react to users' requests or to process a stream of incoming data on time. However, the trend in DNN design is toward larger models with many layers and parameters to achieve more accurate results. Although these models are often pre-trained, the computational complexity in such large models can still be relatively significant, hindering low inference latency. Implementing a caching mechanism is a typical systems engineering solution for speeding up a service response time. However, traditional caching is often not suitable for DNN-based services. In this paper, we propose an end-to-end automated solution to improve the performance of DNN-based services in terms of their computational complexity and inference latency. Our caching method adopts the ideas of self-distillation of DNN models and early exits. The proposed solution is an automated online layer caching mechanism that allows early exiting of a large model during inference time if the cache model in one of the early exits is confident enough for final prediction. One of the main contributions of this paper is that we have implemented the idea as an online caching, meaning that the cache models do not need access to training data and perform solely based on the incoming data at run-time, making it suitable for applications using pre-trained models. Our experiments results on two downstream tasks (face and object classification) show that, on average, caching can reduce the computational complexity of those services up to 58\% (in terms of FLOPs count) and improve their inference latency up to 46\% with low to zero reduction in accuracy.

Lung cancer is the leading cause of cancer related mortality by a significant margin. While new technologies, such as image segmentation, have been paramount to improved detection and earlier diagnoses, there are still significant challenges in treating the disease. In particular, despite an increased number of curative resections, many postoperative patients still develop recurrent lesions. Consequently, there is a significant need for prognostic tools that can more accurately predict a patient's risk for recurrence. In this paper, we explore the use of convolutional neural networks (CNNs) for the segmentation and recurrence risk prediction of lung tumors that are present in preoperative computed tomography (CT) images. First, expanding upon recent progress in medical image segmentation, a residual U-Net is used to localize and characterize each nodule. Then, the identified tumors are passed to a second CNN for recurrence risk prediction. The system's final results are produced with a random forest classifier that synthesizes the predictions of the second network with clinical attributes. The segmentation stage uses the LIDC-IDRI dataset and achieves a dice score of 70.3%. The recurrence risk stage uses the NLST dataset from the National Cancer institute and achieves an AUC of 73.0%. Our proposed framework demonstrates that first, automated nodule segmentation methods can generalize to enable pipelines for a wide range of multitask systems and second, that deep learning and image processing have the potential to improve current prognostic tools. To the best of our knowledge, it is the first fully automated segmentation and recurrence risk prediction system.

Self-supervised learning (SSL) has emerged as a desirable paradigm in computer vision due to the inability of supervised models to learn representations that can generalize in domains with limited labels. The recent popularity of SSL has led to the development of several models that make use of diverse training strategies, architectures, and data augmentation policies with no existing unified framework to study or assess their effectiveness in transfer learning. We propose a data-driven geometric strategy to analyze different SSL models using local neighborhoods in the feature space induced by each. Unlike existing approaches that consider mathematical approximations of the parameters, individual components, or optimization landscape, our work aims to explore the geometric properties of the representation manifolds learned by SSL models. Our proposed manifold graph metrics (MGMs) provide insights into the geometric similarities and differences between available SSL models, their invariances with respect to specific augmentations, and their performances on transfer learning tasks. Our key findings are two fold: (i) contrary to popular belief, the geometry of SSL models is not tied to its training paradigm (contrastive, non-contrastive, and cluster-based); (ii) we can predict the transfer learning capability for a specific model based on the geometric properties of its semantic and augmentation manifolds.

We present a data-driven algorithm that advertisers can use to automate their digital ad-campaigns at online publishers. The algorithm enables the advertiser to search across available target audiences and ad-media to find the best possible combination for its campaign via online experimentation. The problem of finding the best audience-ad combination is complicated by a number of distinctive challenges, including (a) a need for active exploration to resolve prior uncertainty and to speed the search for profitable combinations, (b) many combinations to choose from, giving rise to high-dimensional search formulations, and (c) very low success probabilities, typically just a fraction of one percent. Our algorithm (designated LRDL, an acronym for Logistic Regression with Debiased Lasso) addresses these challenges by combining four elements: a multiarmed bandit framework for active exploration; a Lasso penalty function to handle high dimensionality; an inbuilt debiasing kernel that handles the regularization bias induced by the Lasso; and a semi-parametric regression model for outcomes that promotes cross-learning across arms. The algorithm is implemented as a Thompson Sampler, and to the best of our knowledge, it is the first that can practically address all of the challenges above. Simulations with real and synthetic data show the method is effective and document its superior performance against several benchmarks from the recent high-dimensional bandit literature.

Pruning is one of the predominant approaches for compressing deep neural networks (DNNs). Lately, coresets (provable data summarizations) were leveraged for pruning DNNs, adding the advantage of theoretical guarantees on the trade-off between the compression rate and the approximation error. However, coresets in this domain were either data-dependent or generated under restrictive assumptions on both the model's weights and inputs. In real-world scenarios, such assumptions are rarely satisfied, limiting the applicability of coresets. To this end, we suggest a novel and robust framework for computing such coresets under mild assumptions on the model's weights and without any assumption on the training data. The idea is to compute the importance of each neuron in each layer with respect to the output of the following layer. This is achieved by a combination of L\"{o}wner ellipsoid and Caratheodory theorem. Our method is simultaneously data-independent, applicable to various networks and datasets (due to the simplified assumptions), and theoretically supported. Experimental results show that our method outperforms existing coreset based neural pruning approaches across a wide range of networks and datasets. For example, our method achieved a $62\%$ compression rate on ResNet50 on ImageNet with $1.09\%$ drop in accuracy.

Substantial scholarship has estimated the susceptibility of jobs to automation, but little has examined how job contents evolve in the information age as new technologies substitute for tasks, shifting required skills rather than eliminating entire jobs. Here we explore the patterns and consequences of changes in occupational skill contents and characterize occupations and workers subject to the greatest re-skilling pressure. Recent research suggests that high-skilled STEM and technology-intensive occupations have experienced the highest rates of skill content change. Analyzing 727 occupations across 167 million job posts covering the near-universe of the U.S. online labor market between 2010 and 2018, we find that when skill distance is accounted for, re-skilling pressure is much higher for low-skilled occupations, no matter how "low-skill: is defined, either by skill number, pay level, or education degree. We investigate the implications of uneven occupational skill change on workers and find that those from large labor markets and large employers experienced less change, while non-white males in low-skill jobs are the most demographically vulnerable. We conclude by discussing the broad potential of our skill embedding model, which learns skill proximity from skill co-presence across job posts and represents it as distance in the high-dimensional space of complex human capital that corresponds with skilling costs for workers. This model offers a fine-grained measure of the extent to which jobs evolve, and also indicates in what direction job are evolving, as illustrated by the decline in demand for human-interface skills and the rise for those at the machine-interface.

Membership inference (MI) attacks highlight a privacy weakness in present stochastic training methods for neural networks. It is not well understood, however, why they arise. Are they a natural consequence of imperfect generalization only? Which underlying causes should we address during training to mitigate these attacks? Towards answering such questions, we propose the first approach to explain MI attacks and their connection to generalization based on principled causal reasoning. We offer causal graphs that quantitatively explain the observed MI attack performance achieved for $6$ attack variants. We refute several prior non-quantitative hypotheses that over-simplify or over-estimate the influence of underlying causes, thereby failing to capture the complex interplay between several factors. Our causal models also show a new connection between generalization and MI attacks via their shared causal factors. Our causal models have high predictive power ($0.90$), i.e., their analytical predictions match with observations in unseen experiments often, which makes analysis via them a pragmatic alternative.

Background: The field of software testing is growing and rapidly-evolving. Aims: Based on keywords assigned to publications, we seek to identify predominant research topics and understand how they are connected and have evolved. Method: We apply co-word analysis to map the topology of testing research as a network where author-assigned keywords are connected by edges indicating co-occurrence in publications. Keywords are clustered based on edge density and frequency of connection. We examine the most popular keywords, summarize clusters into high-level research topics, examine how topics connect, and examine how the field is changing. Results: Testing research can be divided into 16 high-level topics and 18 subtopics. Creation guidance, automated test generation, evolution and maintenance, and test oracles have particularly strong connections to other topics, highlighting their multidisciplinary nature. Emerging keywords relate to web and mobile apps, machine learning, energy consumption, automated program repair and test generation, while emerging connections have formed between web apps, test oracles, and machine learning with many topics. Random and requirements-based testing show potential decline. Conclusions: Our observations, advice, and map data offer a deeper understanding of the field and inspiration regarding challenges and connections to explore.

In this work, we present a new dataset and a computational strategy for a digital coach that aims to guide users in practicing the protocols of self-attachment therapy. Our framework augments a rule-based conversational agent with a deep-learning classifier for identifying the underlying emotion in a user's text response, as well as a deep-learning assisted retrieval method for producing novel, fluent and empathetic utterances. We also craft a set of human-like personas that users can choose to interact with. Our goal is to achieve a high level of engagement during virtual therapy sessions. We evaluate the effectiveness of our framework in a non-clinical trial with N=16 participants, all of whom have had at least four interactions with the agent over the course of five days. We find that our platform is consistently rated higher for empathy, user engagement and usefulness than the simple rule-based framework. Finally, we provide guidelines to further improve the design and performance of the application, in accordance with the feedback received.

In this paper, we advocate for two stages in a neural network's decision making process. The first is the existing feed-forward inference framework where patterns in given data are sensed and associated with previously learned patterns. The second stage is a slower reflection stage where we ask the network to reflect on its feed-forward decision by considering and evaluating all available choices. Together, we term the two stages as introspective learning. We use gradients of trained neural networks as a measurement of this reflection. A simple three-layered Multi Layer Perceptron is used as the second stage that predicts based on all extracted gradient features. We perceptually visualize the post-hoc explanations from both stages to provide a visual grounding to introspection. For the application of recognition, we show that an introspective network is 4% more robust and 42% less prone to calibration errors when generalizing to noisy data. We also illustrate the value of introspective networks in downstream tasks that require generalizability and calibration including active learning, out-of-distribution detection, and uncertainty estimation. Finally, we ground the proposed machine introspection to human introspection for the application of image quality assessment.

The Jensen-Shannon divergence is a renown bounded symmetrization of the unbounded Kullback-Leibler divergence which measures the total Kullback-Leibler divergence to the average mixture distribution. However the Jensen-Shannon divergence between Gaussian distributions is not available in closed-form. To bypass this problem, we present a generalization of the Jensen-Shannon (JS) divergence using abstract means which yields closed-form expressions when the mean is chosen according to the parametric family of distributions. More generally, we define the JS-symmetrizations of any distance using generalized statistical mixtures derived from abstract means. In particular, we first show that the geometric mean is well-suited for exponential families, and report two closed-form formula for (i) the geometric Jensen-Shannon divergence between probability densities of the same exponential family, and (ii) the geometric JS-symmetrization of the reverse Kullback-Leibler divergence. As a second illustrating example, we show that the harmonic mean is well-suited for the scale Cauchy distributions, and report a closed-form formula for the harmonic Jensen-Shannon divergence between scale Cauchy distributions. We also define generalized Jensen-Shannon divergences between matrices (e.g., quantum Jensen-Shannon divergences) and consider clustering with respect to these novel Jensen-Shannon divergences.

Natural language modeling with limited training data is a challenging problem, and many algorithms make use of large-scale pretrained language models (PLMs) for this due to its great generalization ability. Among them, additive learning that incorporates a task-specific adapter on top of the fixed large-scale PLM has been popularly used in the few-shot setting. However, this added adapter is still easy to disregard the knowledge of the PLM especially for few-shot natural language generation (NLG) since an entire sequence is usually generated by only the newly trained adapter. Therefore, in this work, we develop a novel additive learning algorithm based on reinforcement learning (RL) that selectively outputs language tokens between the task-general PLM and the task-specific adapter during both training and inference. This output token selection over the two generators allows the adapter to take into account solely the task-relevant parts in sequence generation, and therefore makes it more robust to overfitting as well as more stable in RL training. In addition, to obtain the complementary adapter from the PLM for each few-shot task, we exploit a separate selecting module that is also simultaneously trained using RL. Experimental results on various few-shot NLG tasks including question answering, data-to-text generation and text summarization demonstrate that the proposed selective token generation significantly outperforms the previous additive learning algorithms based on the PLMs.

We introduce a neural stack architecture, including a differentiable parametrized stack operator that approximates stack push and pop operations for suitable choices of parameters that explicitly represents a stack. We prove the stability of this stack architecture: after arbitrarily many stack operations, the state of the neural stack still closely resembles the state of the discrete stack. Using the neural stack with a recurrent neural network, we introduce a neural network Pushdown Automaton (nnPDA) and prove that nnPDA with finite/bounded neurons and time can simulate any PDA. Furthermore, we extend our construction and propose new architecture neural state Turing Machine (nnTM). We prove that differentiable nnTM with bounded neurons can simulate Turing Machine (TM) in real-time. Just like the neural stack, these architectures are also stable. Finally, we extend our construction to show that differentiable nnTM is equivalent to Universal Turing Machine (UTM) and can simulate any TM with only \textbf{seven finite/bounded precision} neurons. This work provides a new theoretical bound for the computational capability of bounded precision RNNs augmented with memory.

We consider regret minimization for Adversarial Markov Decision Processes (AMDPs), where the loss functions are changing over time and adversarially chosen, and the learner only observes the losses for the visited state-action pairs (i.e., bandit feedback). While there has been a surge of studies on this problem using Online-Mirror-Descent (OMD) methods, very little is known about the Follow-the-Perturbed-Leader (FTPL) methods, which are usually computationally more efficient and also easier to implement since it only requires solving an offline planning problem. Motivated by this, we take a closer look at FTPL for learning AMDPs, starting from the standard episodic finite-horizon setting. We find some unique and intriguing difficulties in the analysis and propose a workaround to eventually show that FTPL is also able to achieve near-optimal regret bounds in this case. More importantly, we then find two significant applications: First, the analysis of FTPL turns out to be readily generalizable to delayed bandit feedback with order-optimal regret, while OMD methods exhibit extra difficulties (Jin et al., 2022). Second, using FTPL, we also develop the first no-regret algorithm for learning communicating AMDPs in the infinite-horizon setting with bandit feedback and stochastic transitions. Our algorithm is efficient assuming access to an offline planning oracle, while even for the easier full-information setting, the only existing algorithm (Chandrasekaran and Tewari, 2021) is computationally inefficient.

Assuming a known degradation model, the performance of a learned image super-resolution (SR) model depends on how well the variety of image characteristics within the training set matches those in the test set. As a result, the performance of an SR model varies noticeably from image to image over a test set depending on whether characteristics of specific images are similar to those in the training set or not. Hence, in general, a single SR model cannot generalize well enough for all types of image content. In this work, we show that training multiple SR models for different classes of images (e.g., for text, texture, etc.) to exploit class-specific image priors and employing a post-processing network that learns how to best fuse the outputs produced by these multiple SR models surpasses the performance of state-of-the-art generic SR models. Experimental results clearly demonstrate that the proposed multiple-model SR (MMSR) approach significantly outperforms a single pre-trained state-of-the-art SR model both quantitatively and visually. It even exceeds the performance of the best single class-specific SR model trained on similar text or texture images.

Heterogeneous big data poses many challenges in machine learning. Its enormous scale, high dimensionality, and inherent uncertainty make almost every aspect of machine learning difficult, from providing enough processing power to maintaining model accuracy to protecting privacy. However, perhaps the most imposing problem is that big data is often interspersed with sensitive personal data. Hence, we propose a privacy-preserving hierarchical fuzzy neural network (PP-HFNN) to address these technical challenges while also alleviating privacy concerns. The network is trained with a two-stage optimization algorithm, and the parameters at low levels of the hierarchy are learned with a scheme based on the well-known alternating direction method of multipliers, which does not reveal local data to other agents. Coordination at high levels of the hierarchy is handled by the alternating optimization method, which converges very quickly. The entire training procedure is scalable, fast and does not suffer from gradient vanishing problems like the methods based on back-propagation. Comprehensive simulations conducted on both regression and classification tasks demonstrate the effectiveness of the proposed model.

In populous countries, pending legal cases have been growing exponentially. There is a need for developing techniques for processing and organizing legal documents. In this paper, we introduce a new corpus for structuring legal documents. In particular, we introduce a corpus of legal judgment documents in English that are segmented into topical and coherent parts. Each of these parts is annotated with a label coming from a list of pre-defined Rhetorical Roles. We develop baseline models for automatically predicting rhetorical roles in a legal document based on the annotated corpus. Further, we show the application of rhetorical roles to improve performance on the tasks of summarization and legal judgment prediction. We release the corpus and baseline model code along with the paper.

We study a type of Online Linear Programming (OLP) problem that maximizes the objective function with stochastic inputs. The performance of various algorithms that analyze this type of OLP is well studied when the stochastic inputs follow some i.i.d distribution. The two central questions to ask are: (i) can the algorithms achieve the same efficiency if the stochastic inputs are not i.i.d but still stationary, and (ii) how can we modify our algorithms if we know the stochastic inputs are trendy, hence not stationary. We answer the first question by analyzing a regenerative type of input and show the regret of two popular algorithms are bounded by the same order as their i.i.d counterpart. We discuss the second question in the context of linearly growing inputs and propose two trend-adaptive algorithms. We provide numerical simulations to illustrate the performance of our algorithms under both regenerative and trendy inputs.

Currently there exists rather promising new trend in machine leaning (ML) based on the relationship between neural networks (NN) and Gaussian processes (GP), including many related subtopics, e.g., signal propagation in NNs, theoretical derivation of learning curve for NNs, QFT methods in ML, etc. An important feature of convolutional neural networks (CNN) is their equivariance (consistency) with respect to the symmetry transformations of the input data. In this work we establish a relationship between the many-channel limit for CNNs equivariant with respect to two-dimensional Euclidean group with vector-valued neuron activations and the corresponding independently introduced equivariant Gaussian processes (GP).

We design and analyse quantum transformers, extending the state-of-the-art classical transformer neural network architectures known to be very performant in natural language processing and image analysis. Building upon the previous work of parametrised quantum circuits for data loading and orthogonal neural layers, we introduce three quantum attention mechanisms, including a quantum transformer based on compound matrices. These quantum architectures can be built using shallow quantum circuits and can provide qualitatively different classification models. We performed extensive simulations of the quantum transformers on standard medical image datasets that showed competitive, and at times better, performance compared with the best classical transformers and other classical benchmarks. The computational complexity of our quantum attention layer proves to be advantageous compared with the classical algorithm with respect to the size of the classified images. Our quantum architectures have thousands of parameters compared with the best classical methods with millions of parameters. Finally, we have implemented our quantum transformers on superconducting quantum computers and obtained encouraging results for up to six qubit experiments.

This paper introduces Honor of Kings Arena, a reinforcement learning (RL) environment based on Honor of Kings, one of the world's most popular games at present. Compared to other environments studied in most previous work, ours presents new generalization challenges for competitive reinforcement learning. It is a multi-agent problem with one agent competing against its opponent; and it requires the generalization ability as it has diverse targets to control and diverse opponents to compete with. We describe the observation, action, and reward specifications for the Honor of Kings domain and provide an open-source Python-based interface for communicating with the game engine. We provide twenty target heroes with a variety of tasks in Honor of Kings Arena and present initial baseline results for RL-based methods with feasible computing resources. Finally, we showcase the generalization challenges imposed by Honor of Kings Arena and possible remedies to the challenges. All of the software, including the environment-class, are publicly available at https://github.com/tencent-ailab/hok_env . The documentation is available at https://aiarena.tencent.com/hok/doc/ .

Probabilistic models of language understanding are interpretable and structured, for instance models of metaphor understanding describe inference about latent topics and features. However, these models are manually designed for a specific task. Large language models (LLMs) can perform many tasks through in-context learning, but they lack the clear structure of probabilistic models. In this paper, we use chain-of-thought prompts to introduce structures from probabilistic models into LLMs. These prompts lead the model to infer latent variables and reason about their relationships to choose appropriate paraphrases for metaphors. The latent variables and relationships chosen are informed by theories of metaphor understanding from cognitive psychology. We apply these prompts to the two largest versions of GPT-3 and show that they can improve paraphrase selection.

Color image denoising is frequently encountered in various image processing and computer vision tasks. One traditional strategy is to convert the RGB image to a less correlated color space and denoise each channel of the new space separately. However, such a strategy can not fully exploit the correlated information between channels and is inadequate to obtain satisfactory results. To address this issue, this paper proposes a new multi-channel optimization model for color image denoising under the nuclear norm minus Frobenius norm minimization framework. Specifically, based on the block-matching, the color image is decomposed into overlapping RGB patches. For each patch, we stack its similar neighbors to form the corresponding patch matrix. The proposed model is performed on the patch matrix to recover its noise-free version. During the recovery process, a) a weight matrix is introduced to fully utilize the noise difference between channels; b) the singular values are shrunk adaptively without additionally assigning weights. With them, the proposed model can achieve promising results while keeping simplicity. To solve the proposed model, an accurate and effective algorithm is built based on the alternating direction method of multipliers framework. The solution of each updating step can be analytically expressed in closed-from. Rigorous theoretical analysis proves the solution sequences generated by the proposed algorithm converge to their respective stationary points. Experimental results on both synthetic and real noise datasets demonstrate the proposed model outperforms state-of-the-art models.

In many scenarios, it is necessary to monitor a complex system via a time-series of observations and determine when anomalous exogenous events have occurred so that relevant actions can be taken. Determining whether current observations are abnormal is challenging. It requires learning an extrapolative probabilistic model of the dynamics from historical data, and using a limited number of current observations to make a classification. We leverage recent advances in long-term probabilistic forecasting, namely {\em Deep Probabilistic Koopman}, to build a general method for classifying anomalies in multi-dimensional time-series data. We also show how to utilize models with domain knowledge of the dynamics to reduce type I and type II error. We demonstrate our proposed method on the important real-world task of global atmospheric pollution monitoring, integrating it with NASA's Global Earth System Model. The system successfully detects localized anomalies in air quality due to events such as COVID-19 lockdowns and wildfires.

Mixtures of experts (MoE) models are a popular framework for modeling heterogeneity in data, for both regression and classification problems in statistics and machine learning, due to their flexibility and the abundance of available statistical estimation and model choice tools. Such flexibility comes from allowing the mixture weights (or gating functions) in the MoE model to depend on the explanatory variables, along with the experts (or component densities). This permits the modeling of data arising from more complex data generating processes when compared to the classical finite mixtures and finite mixtures of regression models, whose mixing parameters are independent of the covariates. The use of MoE models in a high-dimensional setting, when the number of explanatory variables can be much larger than the sample size, is challenging from a computational point of view, and in particular from a theoretical point of view, where the literature is still lacking results for dealing with the curse of dimensionality, for both the statistical estimation and feature selection problems. We consider the finite MoE model with soft-max gating functions and Gaussian experts for high-dimensional regression on heterogeneous data, and its $l_1$-regularized estimation via the Lasso. We focus on the Lasso estimation properties rather than its feature selection properties. We provide a lower bound on the regularization parameter of the Lasso function that ensures an $l_1$-oracle inequality satisfied by the Lasso estimator according to the Kullback--Leibler loss.

Stock prices move as piece-wise trending fluctuation rather than a purely random walk. Traditionally, the prediction of future stock movements is based on the historical trading record. Nowadays, with the development of social media, many active participants in the market choose to publicize their strategies, which provides a window to glimpse over the whole market's attitude towards future movements by extracting the semantics behind social media. However, social media contains conflicting information and cannot replace historical records completely. In this work, we propose a multi-modality attention network to reduce conflicts and integrate semantic and numeric features to predict future stock movements comprehensively. Specifically, we first extract semantic information from social media and estimate their credibility based on posters' identity and public reputation. Then we incorporate the semantic from online posts and numeric features from historical records to make the trading strategy. Experimental results show that our approach outperforms previous methods by a significant margin in both prediction accuracy (61.20\%) and trading profits (9.13\%). It demonstrates that our method improves the performance of stock movements prediction and informs future research on multi-modality fusion towards stock prediction.

In this paper, we present a new policy gradient (PG) methods, namely the block policy mirror descent (BPMD) method for solving a class of regularized reinforcement learning (RL) problems with (strongly)-convex regularizers. Compared to the traditional PG methods with a batch update rule, which visits and updates the policy for every state, BPMD method has cheap per-iteration computation via a partial update rule that performs the policy update on a sampled state. Despite the nonconvex nature of the problem and a partial update rule, we provide a unified analysis for several sampling schemes, and show that BPMD achieves fast linear convergence to the global optimality. In particular, uniform sampling leads to comparable worst-case total computational complexity as batch PG methods. A necessary and sufficient condition for convergence with on-policy sampling is also identified. With a hybrid sampling scheme, we further show that BPMD enjoys potential instance-dependent acceleration, leading to improved dependence on the state space and consequently outperforming batch PG methods. We then extend BPMD methods to the stochastic setting, by utilizing stochastic first-order information constructed from samples. With a generative model, $\tilde{\mathcal{O}}(\left\lvert \mathcal{S}\right\rvert \left\lvert \mathcal{A}\right\rvert /\epsilon)$ (resp. $\tilde{\mathcal{O}}(\left\lvert \mathcal{S}\right\rvert \left\lvert \mathcal{A} \right\rvert /\epsilon^2)$) sample complexities are established for the strongly-convex (resp. non-strongly-convex) regularizers, where $\epsilon$ denotes the target accuracy. To the best of our knowledge, this is the first time that block coordinate descent methods have been developed and analyzed for policy optimization in reinforcement learning, which provides a new perspective on solving large-scale RL problems.

Causal discovery for quantitative data has been extensively studied but less is known for categorical data. We propose a novel causal model for categorical data based on a new classification model, termed classification with optimal label permutation (COLP). By design, COLP is a parsimonious classifier, which gives rise to a provably identifiable causal model. A simple learning algorithm via comparing likelihood functions of causal and anti-causal models suffices to learn the causal direction. Through experiments with synthetic and real data, we demonstrate the favorable performance of the proposed COLP-based causal model compared to state-of-the-art methods. We also make available an accompanying R package COLP, which contains the proposed causal discovery algorithm and a benchmark dataset of categorical cause-effect pairs.

Domain generalization (DG) aims to learn a model on several source domains, hoping that the model can generalize well to unseen target domains. The distribution shift between domains contains the covariate shift and conditional shift, both of which the model must be able to handle for better generalizability. In this paper, a novel DG method is proposed to deal with the distribution shift via Visual Alignment and Uncertainty-guided belief Ensemble (VAUE). Specifically, for the covariate shift, a visual alignment module is designed to align the distribution of image style to a common empirical Gaussian distribution so that the covariate shift can be eliminated in the visual space. For the conditional shift, we adopt an uncertainty-guided belief ensemble strategy based on the subjective logic and Dempster-Shafer theory. The conditional distribution given a test sample is estimated by the dynamic combination of that of source domains. Comprehensive experiments are conducted to demonstrate the superior performance of the proposed method on four widely used datasets, i.e., Office-Home, VLCS, TerraIncognita, and PACS.

Recently, self-learning methods based on user satisfaction metrics and contextual bandits have shown promising results to enable consistent improvements in conversational AI systems. However, directly targeting such metrics by off-policy bandit learning objectives often increases the risk of making abrupt policy changes that break the current user experience. In this study, we introduce a scalable framework for supporting fine-grained exploration targets for individual domains via user-defined constraints. For example, we may want to ensure fewer policy deviations in business-critical domains such as shopping, while allocating more exploration budget to domains such as music. Furthermore, we present a novel meta-gradient learning approach that is scalable and practical to address this problem. The proposed method adjusts constraint violation penalty terms adaptively through a meta objective that encourages balanced constraint satisfaction across domains. We conduct extensive experiments using data from a real-world conversational AI on a set of realistic constraint benchmarks. Based on the experimental results, we demonstrate that the proposed approach is capable of achieving the best balance between the policy value and constraint satisfaction rate.

Kratom (KT) typically exerts antidepressant (AD) effects. However, evaluating which form of KT extracts possesses AD properties similar to the standard AD fluoxetine (flu) remained challenging. Here, we adopted an autoencoder (AE)-based anomaly detector called ANet to measure the similarity of mice's local field potential (LFP) features that responded to KT leave extracts and AD flu. The features that responded to KT syrup had the highest similarity to those that responded to the AD flu at 85.62 $\pm$ 0.29%. This finding presents the higher feasibility of using KT syrup as an alternative substance for depressant therapy than KT alkaloids and KT aqueous, which are the other candidates in this study. Apart from the similarity measurement, we utilized ANet as a multi-task AE and evaluated the performance in discriminating multi-class LFP responses corresponding to the effect of different KT extracts and AD flu simultaneously. Furthermore, we visualized learned latent features among LFP responses qualitatively and quantitatively as t-SNE projection and maximum mean discrepancy distance, respectively. The classification results reported the accuracy and F1-score of 79.78 $\pm$ 0.39% and 79.53 $\pm$ 0.00%. In summary, the outcomes of this research might help therapeutic design devices for an alternative substance profile evaluation, such as Kratom-based form in real-world applications.

Robustness is becoming another important challenge of federated learning in that the data collection process in each client is naturally accompanied by noisy labels. However, it is far more complex and challenging owing to varying levels of data heterogeneity and noise over clients, which exacerbates the client-to-client performance discrepancy. In this work, we propose a robust federated learning method called FedRN, which exploits k-reliable neighbors with high data expertise or similarity. Our method helps mitigate the gap between low- and high-performance clients by training only with a selected set of clean examples, identified by their ensembled mixture models. We demonstrate the superiority of FedRN via extensive evaluations on three real-world or synthetic benchmark datasets. Compared with existing robust training methods, the results show that FedRN significantly improves the test accuracy in the presence of noisy labels.

Flow-based generative super-resolution (SR) models learn to produce a diverse set of feasible SR solutions, called the SR space. Diversity of SR solutions increases with the temperature ($\tau$) of latent variables, which introduces random variations of texture among sample solutions, resulting in visual artifacts and low fidelity. In this paper, we present a simple but effective image ensembling/fusion approach to obtain a single SR image eliminating random artifacts and improving fidelity without significantly compromising perceptual quality. We achieve this by benefiting from a diverse set of feasible photo-realistic solutions in the SR space spanned by flow models. We propose different image ensembling and fusion strategies which offer multiple paths to move sample solutions in the SR space to more desired destinations in the perception-distortion plane in a controllable manner depending on the fidelity vs. perceptual quality requirements of the task at hand. Experimental results demonstrate that our image ensembling/fusion strategy achieves more promising perception-distortion trade-off compared to sample SR images produced by flow models and adversarially trained models in terms of both quantitative metrics and visual quality.

Imaging of facial affects may be used to measure psychophysiological attributes of children through their adulthood, especially for monitoring lifelong conditions like Autism Spectrum Disorder. Deep convolutional neural networks have shown promising results in classifying facial expressions of adults. However, classifier models trained with adult benchmark data are unsuitable for learning child expressions due to discrepancies in psychophysical development. Similarly, models trained with child data perform poorly in adult expression classification. We propose domain adaptation to concurrently align distributions of adult and child expressions in a shared latent space to ensure robust classification of either domain. Furthermore, age variations in facial images are studied in age-invariant face recognition yet remain unleveraged in adult-child expression classification. We take inspiration from multiple fields and propose deep adaptive FACial Expressions fusing BEtaMix SElected Landmark Features (FACE-BE-SELF) for adult-child facial expression classification. For the first time in the literature, a mixture of Beta distributions is used to decompose and select facial features based on correlations with expression, domain, and identity factors. We evaluate FACE-BE-SELF on two pairs of adult-child data sets. Our proposed FACE-BE-SELF approach outperforms adult-child transfer learning and other baseline domain adaptation methods in aligning latent representations of adult and child expressions.

The growing use of probe vehicles generates a huge number of GNSS data. Limited by the satellite positioning technology, further improving the accuracy of map-matching is challenging work, especially for low-frequency trajectories. When matching a trajectory, the ego vehicle's spatial-temporal information of the present trip is the most useful with the least amount of data. In addition, there are a large amount of other data, e.g., other vehicles' state and past prediction results, but it is hard to extract useful information for matching maps and inferring paths. Most map-matching studies only used the ego vehicle's data and ignored other vehicles' data. Based on it, this paper designs a new map-matching method to make full use of "Big data". We first sort all data into four groups according to their spatial and temporal distance from the present matching probe which allows us to sort for their usefulness. Then we design three different methods to extract valuable information (scores) from them: a score for speed and bearing, a score for historical usage, and a score for traffic state using the spectral graph Markov neutral network. Finally, we use a modified top-K shortest-path method to search the candidate paths within an ellipse region and then use the fused score to infer the path (projected location). We test the proposed method against baseline algorithms using a real-world dataset in China. The results show that all scoring methods can enhance map-matching accuracy. Furthermore, our method outperforms the others, especially when GNSS probing frequency is less than 0.01 Hz.

The random Fourier features (RFFs) method is a powerful and popular technique in kernel approximation for scalability of kernel methods. The theoretical foundation of RFFs is based on the Bochner theorem that relates symmetric, positive definite (PD) functions to probability measures. This condition naturally excludes asymmetric functions with a wide range applications in practice, e.g., directed graphs, conditional probability, and asymmetric kernels. Nevertheless, understanding asymmetric functions (kernels) and its scalability via RFFs is unclear both theoretically and empirically. In this paper, we introduce a complex measure with the real and imaginary parts corresponding to four finite positive measures, which expands the application scope of the Bochner theorem. By doing so, this framework allows for handling classical symmetric, PD kernels via one positive measure; symmetric, non-positive definite kernels via signed measures; and asymmetric kernels via complex measures, thereby unifying them into a general framework by RFFs, named AsK-RFFs. Such approximation scheme via complex measures enjoys theoretical guarantees in the perspective of the uniform convergence. In algorithmic implementation, to speed up the kernel approximation process, which is expensive due to the calculation of total mass, we employ a subset-based fast estimation method that optimizes total masses on a sub-training set, which enjoys computational efficiency in high dimensions. Our AsK-RFFs method is empirically validated on several typical large-scale datasets and achieves promising kernel approximation performance, which demonstrate the effectiveness of AsK-RFFs.

Flocking control is a challenging problem, where multiple agents, such as drones or vehicles, need to reach a target position while maintaining the flock and avoiding collisions with obstacles and collisions among agents in the environment. Multi-agent reinforcement learning has achieved promising performance in flocking control. However, methods based on traditional reinforcement learning require a considerable number of interactions between agents and the environment. This paper proposes a sub-optimal policy aided multi-agent reinforcement learning algorithm (SPA-MARL) to boost sample efficiency. SPA-MARL directly leverages a prior policy that can be manually designed or solved with a non-learning method to aid agents in learning, where the performance of the policy can be sub-optimal. SPA-MARL recognizes the difference in performance between the sub-optimal policy and itself, and then imitates the sub-optimal policy if the sub-optimal policy is better. We leverage SPA-MARL to solve the flocking control problem. A traditional control method based on artificial potential fields is used to generate a sub-optimal policy. Experiments demonstrate that SPA-MARL can speed up the training process and outperform both the MARL baseline and the used sub-optimal policy.

Graph Neural Networks (GNNs) are popular machine learning methods for modeling graph data. A lot of GNNs perform well on homophily graphs while having unsatisfactory performance on heterophily graphs. Recently, some researchers turn their attention to designing GNNs for heterophily graphs by adjusting the message passing mechanism or enlarging the receptive field of the message passing. Different from existing works that mitigate the issues of heterophily from model design perspective, we propose to study heterophily graphs from an orthogonal perspective by rewiring the graph structure to reduce heterophily and making the traditional GNNs perform better. Through comprehensive empirical studies and analysis, we verify the potential of the rewiring methods. To fully exploit its potential, we propose a method named Deep Heterophily Graph Rewiring (DHGR) to rewire graphs by adding homophilic edges and pruning heterophilic edges. The detailed way of rewiring is determined by comparing the similarity of label/feature-distribution of node neighbors. Besides, we design a scalable implementation for DHGR to guarantee high efficiency. DHRG can be easily used as a plug-in module, i.e., a graph pre-processing step, for any GNNs, including both GNN for homophily and heterophily, to boost their performance on the node classification task. To the best of our knowledge, it is the first work studying graph rewiring for heterophily graphs. Extensive experiments on 11 public graph datasets demonstrate the superiority of our proposed methods.

In this paper we consider the possibility of computing rather than training the decision layer weights of a neural classifier. Such a possibility arises in two way, from making an appropriate choice of loss function and by solving a problem of constrained optimization. The latter formulation leads to a promising new learning process for pre-decision weights with both simplicity and efficacy.

We consider the problem of estimating the topology of multiple networks from nodal observations, where these networks are assumed to be drawn from the same (unknown) random graph model. We adopt a graphon as our random graph model, which is a nonparametric model from which graphs of potentially different sizes can be drawn. The versatility of graphons allows us to tackle the joint inference problem even for the cases where the graphs to be recovered contain different number of nodes and lack precise alignment across the graphs. Our solution is based on combining a maximum likelihood penalty with graphon estimation schemes and can be used to augment existing network inference methods. The proposed joint network and graphon estimation is further enhanced with the introduction of a robust method for noisy graph sampling information. We validate our proposed approach by comparing its performance against competing methods in synthetic and real-world datasets.

A core challenge for an autonomous agent acting in the real world is to adapt its repertoire of skills to cope with its noisy perception and dynamics. To scale learning of skills to long-horizon tasks, robots should be able to learn and later refine their skills in a structured manner through trajectories rather than making instantaneous decisions individually at each time step. To this end, we propose the Soft Actor-Critic Gaussian Mixture Model (SAC-GMM), a novel hybrid approach that learns robot skills through a dynamical system and adapts the learned skills in their own trajectory distribution space through interactions with the environment. Our approach combines classical robotics techniques of learning from demonstration with the deep reinforcement learning framework and exploits their complementary nature. We show that our method utilizes sensors solely available during the execution of preliminarily learned skills to extract relevant features that lead to faster skill refinement. Extensive evaluations in both simulation and real-world environments demonstrate the effectiveness of our method in refining robot skills by leveraging physical interactions, high-dimensional sensory data, and sparse task completion rewards. Videos, code, and pre-trained models are available at this http URL

Deployed machine learning (ML) models often encounter new user data that differs from their training data. Therefore, estimating how well a given model might perform on the new data is an important step toward reliable ML applications. This is very challenging, however, as the data distribution can change in flexible ways, and we may not have any labels on the new data, which is often the case in monitoring settings. In this paper, we propose a new distribution shift model, Sparse Joint Shift (SJS), which considers the joint shift of both labels and a few features. This unifies and generalizes several existing shift models including label shift and sparse covariate shift, where only marginal feature or label distribution shifts are considered. We describe mathematical conditions under which SJS is identifiable. We further propose SEES, an algorithmic framework to characterize the distribution shift under SJS and to estimate a model's performance on new data without any labels. We conduct extensive experiments on several real-world datasets with various ML models. Across different datasets and distribution shifts, SEES achieves significant (up to an order of magnitude) shift estimation error improvements over existing approaches.

Optimal scaling has been well studied for Metropolis-Hastings (M-H) algorithms in continuous spaces, but a similar understanding has been lacking in discrete spaces. Recently, a family of locally balanced proposals (LBP) for discrete spaces has been proved to be asymptotically optimal, but the question of optimal scaling has remained open. In this paper, we establish, for the first time, that the efficiency of M-H in discrete spaces can also be characterized by an asymptotic acceptance rate that is independent of the target distribution. Moreover, we verify, both theoretically and empirically, that the optimal acceptance rates for LBP and random walk Metropolis (RWM) are $0.574$ and $0.234$ respectively. These results also help establish that LBP is asymptotically $O(N^\frac{2}{3})$ more efficient than RWM with respect to model dimension $N$. Knowledge of the optimal acceptance rate allows one to automatically tune the neighborhood size of a proposal distribution in a discrete space, directly analogous to step-size control in continuous spaces. We demonstrate empirically that such adaptive M-H sampling can robustly improve sampling in a variety of target distributions in discrete spaces, including training deep energy based models.  ( 2 min )

Fairness testing aims at mitigating unintended discrimination in the decision-making process of data-driven AI systems. Individual discrimination may occur when an AI model makes different decisions for two distinct individuals who are distinguishable solely according to protected attributes, such as age and race. Such instances reveal biased AI behaviour, and are called Individual Discriminatory Instances (IDIs). In this paper, we propose an approach for the selection of the initial seeds to generate IDIs for fairness testing. Previous studies mainly used random initial seeds to this end. However this phase is crucial, as these seeds are the basis of the follow-up IDIs generation. We dubbed our proposed seed selection approach I&D. It generates a large number of initial IDIs exhibiting a great diversity, aiming at improving the overall performance of fairness testing. Our empirical study reveal that I&D is able to produce a larger number of IDIs with respect to four state-of-the-art seed generation approaches, generating 1.68X more IDIs on average. Moreover, we compare the use of I&D to train machine learning models and find that using I&D reduces the number of remaining IDIs by 29% when compared to the state-of-the-art, thus indicating that I&D is effective for improving model fairness  ( 2 min )

A significant percentage of COVID-19 survivors experience ongoing multisystemic symptoms that often affect daily living, a condition known as Long Covid or post-acute-sequelae of SARS-CoV-2 infection. However, identifying Long Covid articles is challenging since articles refer to the condition using a variety of less common terms or refrain from naming it at all. We developed an iterative human-in-the-loop machine learning framework designed to effectively leverage the data available and make the most efficient use of human labels. Specifically, our approach combines data programming with active learning into a robust ensemble model. Evaluating our model on a holdout set demonstrates over three times the sensitivity of other methods. We apply our model to PubMed to create the Long Covid collection, and demonstrate that (1) most Long Covid articles do not refer to Long Covid by any name (2) when the condition is named, the name used most frequently in the biomedical literature is Long Covid, and (3) Long Covid is associated with disorders in a wide variety of body systems. The Long Covid collection is updated weekly and is searchable online at the LitCovid portal: https://www.ncbi.nlm.nih.gov/research/coronavirus/docsum?filters=e_condition.LongCovid  ( 3 min )

Predictions and forecasts of machine learning models should take the form of probability distributions, aiming to increase the quantity of information communicated to end users. Although applications of probabilistic prediction and forecasting with machine learning models in academia and industry are becoming more frequent, related concepts and methods have not been formalized and structured under a holistic view of the entire field. Here, we review the topic of predictive uncertainty estimation with machine learning algorithms, as well as the related metrics (consistent scoring functions and proper scoring rules) for assessing probabilistic predictions. The review covers a time period spanning from the introduction of early statistical (linear regression and time series models, based on Bayesian statistics or quantile regression) to recent machine learning algorithms (including generalized additive models for location, scale and shape, random forests, boosting and deep learning algorithms) that are more flexible by nature. The review of the progress in the field, expedites our understanding on how to develop new algorithms tailored to users' needs, since the latest advancements are based on some fundamental concepts applied to more complex algorithms. We conclude by classifying the material and discussing challenges that are becoming a hot topic of research.  ( 2 min )

State estimation is an important aspect in many robotics applications. In this work, we consider the task of obtaining accurate state estimates for robotic systems by enhancing the dynamics model used in state estimation algorithms. Existing frameworks such as moving horizon estimation (MHE) and the unscented Kalman filter (UKF) provide the flexibility to incorporate nonlinear dynamics and measurement models. However, this implies that the dynamics model within these algorithms has to be sufficiently accurate in order to warrant the accuracy of the state estimates. To enhance the dynamics models and improve the estimation accuracy, we utilize a deep learning framework known as knowledge-based neural ordinary differential equations (KNODEs). The KNODE framework embeds prior knowledge into the training procedure and synthesizes an accurate hybrid model by fusing a prior first-principles model with a neural ordinary differential equation (NODE) model. In our proposed LEARNEST framework, we integrate the data-driven model into two novel model-based state estimation algorithms, which are denoted as KNODE-MHE and KNODE-UKF. These two algorithms are compared against their conventional counterparts across a number of robotic applications; state estimation for a cartpole system using partial measurements, localization for a ground robot, as well as state estimation for a quadrotor. Through simulations and tests using real-world experimental data, we demonstrate the versatility and efficacy of the proposed learning-enhanced state estimation framework.  ( 3 min )

We propose a new data augmentation technique for semi-supervised learning settings that emphasizes learning from the most challenging regions of the feature space. Starting with a fully supervised reference model, we first identify low confidence predictions. These samples are then used to train a Variational AutoEncoder (VAE) that can generate an infinite number of additional images with similar distribution. Finally, using the originally labeled data and the synthetically generated labeled and unlabeled data, we retrain a new model in a semi-supervised fashion. We perform experiments on two benchmark RGB datasets: CIFAR-100 and STL-10, and show that the proposed scheme improves classification performance in terms of accuracy and robustness, while yielding comparable or superior results with respect to existing fully supervised approaches  ( 2 min )

We introduce De Bruijn Graph Neural Networks (DBGNNs), a novel time-aware graph neural network architecture for time-resolved data on dynamic graphs. Our approach accounts for temporal-topological patterns that unfold in the causal topology of dynamic graphs, which is determined by causal walks, i.e. temporally ordered sequences of links by which nodes can influence each other over time. Our architecture builds on multiple layers of higher-order De Bruijn graphs, an iterative line graph construction where nodes in a De Bruijn graph of order k represent walks of length k-1, while edges represent walks of length k. We develop a graph neural network architecture that utilizes De Bruijn graphs to implement a message passing scheme that follows a non-Markovian dynamics, which enables us to learn patterns in the causal topology of a dynamic graph. Addressing the issue that De Bruijn graphs with different orders k can be used to model the same data set, we further apply statistical model selection to determine the optimal graph topology to be used for message passing. An evaluation in synthetic and empirical data sets suggests that DBGNNs can leverage temporal patterns in dynamic graphs, which substantially improves the performance in a supervised node classification task.  ( 2 min )

Transductive Few-Shot learning has gained increased attention nowadays considering the cost of data annotations along with the increased accuracy provided by unlabelled samples in the domain of few shot. Especially in Few-Shot Classification (FSC), recent works explore the feature distributions aiming at maximizing likelihoods or posteriors with respect to the unknown parameters. Following this vein, and considering the parallel between FSC and clustering, we seek for better taking into account the uncertainty in estimation due to lack of data, as well as better statistical properties of the clusters associated with each class. Therefore in this paper we propose a new clustering method based on Variational Bayesian inference, further improved by Adaptive Dimension Reduction based on Probabilistic Linear Discriminant Analysis. Our proposed method significantly improves accuracy in the realistic unbalanced transductive setting on various Few-Shot benchmarks when applied to features used in previous studies, with a gain of up to $6\%$ in accuracy. In addition, when applied to balanced setting, we obtain very competitive results without making use of the class-balance artefact which is disputable for practical use cases. We also provide the performance of our method on a high performing pretrained backbone, with the reported results further surpassing the current state-of-the-art accuracy, suggesting the genericity of the proposed method.  ( 2 min )

Commercial ML APIs offered by providers such as Google, Amazon and Microsoft have dramatically simplified ML adoption in many applications. Numerous companies and academics pay to use ML APIs for tasks such as object detection, OCR and sentiment analysis. Different ML APIs tackling the same task can have very heterogeneous performance. Moreover, the ML models underlying the APIs also evolve over time. As ML APIs rapidly become a valuable marketplace and a widespread way to consume machine learning, it is critical to systematically study and compare different APIs with each other and to characterize how APIs change over time. However, this topic is currently underexplored due to the lack of data. In this paper, we present HAPI (History of APIs), a longitudinal dataset of 1,761,417 instances of commercial ML API applications (involving APIs from Amazon, Google, IBM, Microsoft and other providers) across diverse tasks including image tagging, speech recognition and text mining from 2020 to 2022. Each instance consists of a query input for an API (e.g., an image or text) along with the API's output prediction/annotation and confidence scores. HAPI is the first large-scale dataset of ML API usages and is a unique resource for studying ML-as-a-service (MLaaS). As examples of the types of analyses that HAPI enables, we show that ML APIs' performance change substantially over time--several APIs' accuracies dropped on specific benchmark datasets. Even when the API's aggregate performance stays steady, its error modes can shift across different subtypes of data between 2020 and 2022. Such changes can substantially impact the entire analytics pipelines that use some ML API as a component. We further use HAPI to study commercial APIs' performance disparities across demographic subgroups over time. HAPI can stimulate more research in the growing field of MLaaS.  ( 3 min )

We address the problem of online sequential decision making, i.e., balancing the trade-off between exploiting the current knowledge to maximize immediate performance and exploring the new information to gain long-term benefits using the multi-armed bandit framework. Thompson sampling is one of the heuristics for choosing actions that address this exploration-exploitation dilemma. We first propose a general framework that helps heuristically tune the exploration versus exploitation trade-off in Thompson sampling using multiple samples from the posterior distribution. Utilizing this framework, we propose two algorithms for the multi-armed bandit problem and provide theoretical bounds on the cumulative regret. Next, we demonstrate the empirical improvement in the cumulative regret performance of the proposed algorithm over Thompson Sampling. We also show the effectiveness of the proposed algorithm on real-world datasets. Contrary to the existing methods, our framework provides a mechanism to vary the amount of exploration/ exploitation based on the task at hand. Towards this end, we extend our framework for two additional problems, i.e., best arm identification and time-sensitive learning in bandits and compare our algorithm with existing methods.  ( 2 min )

This paper is aiming to apply neural network algorithm for predicting the process response (NOx emissions) from degrading natural gas turbines. Nine different process variables, or predictors, are considered in the predictive modelling. It is found out that the model trained by neural network algorithm should use part of recent data in the training and validation sets accounting for the impact of the system degradation. R-Square values of the training and validation sets demonstrate the validity of the model. The residue plot, without any clear pattern, shows the model is appropriate. The ranking of the importance of the process variables are demonstrated and the prediction profile confirms the significance of the process variables. The model trained by using neural network algorithm manifests the optimal settings of the process variables to reach the minimum value of NOx emissions from the degrading gas turbine system.

We develop a modified online mirror descent framework that is suitable for building adaptive and parameter-free algorithms in unbounded domains. We leverage this technique to develop the first unconstrained online linear optimization algorithm achieving an optimal dynamic regret bound, and we further demonstrate that natural strategies based on Follow-the-Regularized-Leader are unable to achieve similar results. We also apply our mirror descent framework to build new parameter-free implicit updates, as well as a simplified and improved unconstrained scale-free algorithm.

Best subset of groups selection (BSGS) is the process of selecting a small part of non-overlapping groups to achieve the best interpretability on the response variable. It has attracted increasing attention and has far-reaching applications in practice. However, due to the computational intractability of BSGS in high-dimensional settings, developing efficient algorithms for solving BSGS remains a research hotspot. In this paper,we propose a group-splicing algorithm that iteratively detects the relevant groups and excludes the irrelevant ones. Moreover, coupled with a novel group information criterion, we develop an adaptive algorithm to determine the optimal model size. Under mild conditions, it is certifiable that our algorithm can identify the optimal subset of groups in polynomial time with high probability. Finally, we demonstrate the efficiency and accuracy of our methods by comparing them with several state-of-the-art algorithms on both synthetic and real-world datasets.

Off-policy Evaluation (OPE) methods are crucial tools for evaluating policies in high-stakes domains such as healthcare, where direct deployment is often infeasible, unethical, or expensive. When deployment environments are expected to undergo changes (that is, dataset shifts), it is important for OPE methods to perform robust evaluation of the policies amidst such changes. Existing approaches consider robustness against a large class of shifts that can arbitrarily change any observable property of the environment. This often results in highly pessimistic estimates of the utilities, thereby invalidating policies that might have been useful in deployment. In this work, we address the aforementioned problem by investigating how domain knowledge can help provide more realistic estimates of the utilities of policies. We leverage human inputs on which aspects of the environments may plausibly change, and adapt the OPE methods to only consider shifts on these aspects. Specifically, we propose a novel framework, Robust OPE (ROPE), which considers shifts on a subset of covariates in the data based on user inputs, and estimates worst-case utility under these shifts. We then develop computationally efficient algorithms for OPE that are robust to the aforementioned shifts for contextual bandits and Markov decision processes. We also theoretically analyze the sample complexity of these algorithms. Extensive experimentation with synthetic and real world datasets from the healthcare domain demonstrates that our approach not only captures realistic dataset shifts accurately, but also results in less pessimistic policy evaluations.

Parameter learning for high-dimensional, partially observed, and nonlinear stochastic processes is a methodological challenge. Spatiotemporal disease transmission systems provide examples of such processes giving rise to open inference problems. We propose the iterated block particle filter (IBPF) algorithm for learning high-dimensional parameters over graphical state space models with general state spaces, measures, transition densities and graph structure. Theoretical performance guarantees are obtained on beating the curse of dimensionality (COD), algorithm convergence, and likelihood maximization. Experiments on a highly nonlinear and non-Gaussian spatiotemporal model for measles transmission reveal that the iterated ensemble Kalman filter algorithm (Li et al. (2020)) is ineffective and the iterated filtering algorithm (Ionides et al. (2015)) suffers from the COD, while our IBPF algorithm beats COD consistently across various experiments with different metrics.

Although overparameterized models have shown their success on many machine learning tasks, the accuracy could drop on the testing distribution that is different from the training one. This accuracy drop still limits applying machine learning in the wild. At the same time, importance weighting, a traditional technique to handle distribution shifts, has been demonstrated to have less or even no effect on overparameterized models both empirically and theoretically. In this paper, we propose importance tempering to improve the decision boundary and achieve consistently better results for overparameterized models. Theoretically, we justify that the selection of group temperature can be different under label shift and spurious correlation setting. At the same time, we also prove that properly selected temperatures can extricate the minority collapse for imbalanced classification. Empirically, we achieve state-of-the-art results on worst group classification tasks using importance tempering.

We introduce a neural stack architecture, including a differentiable parametrized stack operator that approximates stack push and pop operations for suitable choices of parameters that explicitly represents a stack. We prove the stability of this stack architecture: after arbitrarily many stack operations, the state of the neural stack still closely resembles the state of the discrete stack. Using the neural stack with a recurrent neural network, we introduce a neural network Pushdown Automaton (nnPDA) and prove that nnPDA with finite/bounded neurons and time can simulate any PDA. Furthermore, we extend our construction and propose new architecture neural state Turing Machine (nnTM). We prove that differentiable nnTM with bounded neurons can simulate Turing Machine (TM) in real-time. Just like the neural stack, these architectures are also stable. Finally, we extend our construction to show that differentiable nnTM is equivalent to Universal Turing Machine (UTM) and can simulate any TM with only \textbf{seven finite/bounded precision} neurons. This work provides a new theoretical bound for the computational capability of bounded precision RNNs augmented with memory.

With model trustworthiness being crucial for sensitive real-world applications, practitioners are putting more and more focus on improving the uncertainty calibration of deep neural networks. Calibration errors are designed to quantify the reliability of probabilistic predictions but their estimators are usually biased and inconsistent. In this work, we introduce the framework of proper calibration errors, which relates every calibration error to a proper score and provides a respective upper bound with optimal estimation properties. This relationship can be used to reliably quantify the model calibration improvement. We theoretically and empirically demonstrate the shortcomings of commonly used estimators compared to our approach. Due to the wide applicability of proper scores, this gives a natural extension of recalibration beyond classification.  ( 2 min )

We introduce a simple and intuitive framework that provides quantitative explanations of statistical models through the probabilistic assessment of input feature importance. The core idea comes from utilizing the Dirichlet distribution to define the importance of input features and learning it via approximate Bayesian inference. The learned importance has probabilistic interpretation and provides the relative significance of each input feature to a model's output, additionally assessing confidence about its importance quantification. As a consequence of using the Dirichlet distribution over the explanations, we can define a closed-form divergence to gauge the similarity between learned importance under different models. We use this divergence to study the feature importance explainability tradeoffs with essential notions in modern machine learning, such as privacy and fairness. Furthermore, BIF can work on two levels: global explanation (feature importance across all data instances) and local explanation (individual feature importance for each data instance). We show the effectiveness of our method on a variety of synthetic and real datasets, taking into account both tabular and image datasets. The code is available at https://github.com/kamadforge/featimp_dp.  ( 2 min )

The problem of inferring the direct causal parents of a response variable among a large set of explanatory variables is of high practical importance in many disciplines. However, established approaches often scale at least exponentially with the number of explanatory variables, are difficult to extend to nonlinear relationships, and are difficult to extend to cyclic data. Inspired by {\em Debiased} machine learning methods, we study a one-vs.-the-rest feature selection approach to discover the direct causal parent of the response. We propose an algorithm that works for purely observational data while also offering theoretical guarantees, including the case of partially nonlinear relationships possibly under the presence of cycles. As it requires only one estimation for each variable, our approach is applicable even to large graphs. We demonstrate significant improvements compared to established approaches.  ( 2 min )

Federated learning, where algorithms are trained across multiple decentralized devices without sharing local data, is increasingly popular in distributed machine learning practice. Typically, a graph structure $G$ exists behind local devices for communication. In this work, we consider parameter estimation in federated learning with data distribution and communication heterogeneity, as well as limited computational capacity of local devices. We encode the distribution heterogeneity by parametrizing distributions on local devices with a set of distinct $p$-dimensional vectors. We then propose to jointly estimate parameters of all devices under the $M$-estimation framework with the fused Lasso regularization, encouraging an equal estimate of parameters on connected devices in $G$. We provide a general result for our estimator depending on $G$, which can be further calibrated to obtain convergence rates for various specific problem setups. Surprisingly, our estimator attains the optimal rate under certain graph fidelity condition on $G$, as if we could aggregate all samples sharing the same distribution. If the graph fidelity condition is not met, we propose an edge selection procedure via multiple testing to ensure the optimality. To ease the burden of local computation, a decentralized stochastic version of ADMM is provided, with convergence rate $O(T^{-1}\log T)$ where $T$ denotes the number of iterations. We highlight that, our algorithm transmits only parameters along edges of $G$ at each iteration, without requiring a central machine, which preserves privacy. We further extend it to the case where devices are randomly inaccessible during the training process, with a similar algorithmic convergence guarantee. The computational and statistical efficiency of our method is evidenced by simulation experiments and the 2020 US presidential election data set.  ( 3 min )

Most knowledge graphs (KGs) are incomplete, which motivates one important research topic on automatically complementing knowledge graphs. However, evaluation of knowledge graph completion (KGC) models often ignores the incompleteness -- facts in the test set are ranked against all unknown triplets which may contain a large number of missing facts not included in the KG yet. Treating all unknown triplets as false is called the closed-world assumption. This closed-world assumption might negatively affect the fairness and consistency of the evaluation metrics. In this paper, we study KGC evaluation under a more realistic setting, namely the open-world assumption, where unknown triplets are considered to include many missing facts not included in the training or test sets. For the currently most used metrics such as mean reciprocal rank (MRR) and Hits@K, we point out that their behavior may be unexpected under the open-world assumption. Specifically, with not many missing facts, their numbers show a logarithmic trend with respect to the true strength of the model, and thus, the metric increase could be insignificant in terms of reflecting the true model improvement. Further, considering the variance, we show that the degradation in the reported numbers may result in incorrect comparisons between different models, where stronger models may have lower metric numbers. We validate the phenomenon both theoretically and experimentally. Finally, we suggest possible causes and solutions for this problem. Our code and data are available at https://github.com/GraphPKU/Open-World-KG .  ( 3 min )

We consider regret minimization for Adversarial Markov Decision Processes (AMDPs), where the loss functions are changing over time and adversarially chosen, and the learner only observes the losses for the visited state-action pairs (i.e., bandit feedback). While there has been a surge of studies on this problem using Online-Mirror-Descent (OMD) methods, very little is known about the Follow-the-Perturbed-Leader (FTPL) methods, which are usually computationally more efficient and also easier to implement since it only requires solving an offline planning problem. Motivated by this, we take a closer look at FTPL for learning AMDPs, starting from the standard episodic finite-horizon setting. We find some unique and intriguing difficulties in the analysis and propose a workaround to eventually show that FTPL is also able to achieve near-optimal regret bounds in this case. More importantly, we then find two significant applications: First, the analysis of FTPL turns out to be readily generalizable to delayed bandit feedback with order-optimal regret, while OMD methods exhibit extra difficulties (Jin et al., 2022). Second, using FTPL, we also develop the first no-regret algorithm for learning communicating AMDPs in the infinite-horizon setting with bandit feedback and stochastic transitions. Our algorithm is efficient assuming access to an offline planning oracle, while even for the easier full-information setting, the only existing algorithm (Chandrasekaran and Tewari, 2021) is computationally inefficient.  ( 3 min )

The CP decomposition for high dimensional non-orthogonal spiked tensors is an important problem with broad applications across many disciplines. However, previous works with theoretical guarantee typically assume restrictive incoherence conditions on the basis vectors for the CP components. In this paper, we propose new computationally efficient composite PCA and concurrent orthogonalization algorithms for tensor CP decomposition with theoretical guarantees under mild incoherence conditions. The composite PCA applies the principal component or singular value decompositions twice, first to a matrix unfolding of the tensor data to obtain singular vectors and then to the matrix folding of the singular vectors obtained in the first step. It can be used as an initialization for any iterative optimization schemes for the tensor CP decomposition. The concurrent orthogonalization algorithm iteratively estimates the basis vector in each mode of the tensor by simultaneously applying projections to the orthogonal complements of the spaces generated by other CP components in other modes. It is designed to improve the alternating least squares estimator and other forms of the high order orthogonal iteration for tensors with low or moderately high CP ranks, and it is guaranteed to converge rapidly when the error of any given initial estimator is bounded by a small constant. Our theoretical investigation provides estimation accuracy and convergence rates for the two proposed algorithms. Both proposed algorithms are applicable to deterministic tensor, its noisy version, and the order-$2K$ covariance tensor of order-$K$ tensor data in a factor model with uncorrelated factors. Our implementations on synthetic data demonstrate significant practical superiority of our approach over existing methods.  ( 3 min )

We design fast algorithms for repeatedly sampling from strongly Rayleigh distributions, which include random spanning tree distributions and determinantal point processes. For a graph $G=(V, E)$, we show how to approximately sample uniformly random spanning trees from $G$ in $\widetilde{O}(\lvert V\rvert)$ time per sample after an initial $\widetilde{O}(\lvert E\rvert)$ time preprocessing. For a determinantal point process on subsets of size $k$ of a ground set of $n$ elements, we show how to approximately sample in $\widetilde{O}(k^\omega)$ time after an initial $\widetilde{O}(nk^{\omega-1})$ time preprocessing, where $\omega<2.372864$ is the matrix multiplication exponent. We even improve the state of the art for obtaining a single sample from determinantal point processes, from the prior runtime of $\widetilde{O}(\min\{nk^2, n^\omega\})$ to $\widetilde{O}(nk^{\omega-1})$. In our main technical result, we achieve the optimal limit on domain sparsification for strongly Rayleigh distributions. In domain sparsification, sampling from a distribution $\mu$ on $\binom{[n]}{k}$ is reduced to sampling from related distributions on $\binom{[t]}{k}$ for $t\ll n$. We show that for strongly Rayleigh distributions, we can can achieve the optimal $t=\widetilde{O}(k)$. Our reduction involves sampling from $\widetilde{O}(1)$ domain-sparsified distributions, all of which can be produced efficiently assuming convenient access to approximate overestimates for marginals of $\mu$. Having access to marginals is analogous to having access to the mean and covariance of a continuous distribution, or knowing "isotropy" for the distribution, the key assumption behind the Kannan-Lov\'asz-Simonovits (KLS) conjecture and optimal samplers based on it. We view our result as a moral analog of the KLS conjecture and its consequences for sampling, for discrete strongly Rayleigh measures.  ( 3 min )

Homomorphic sensing is a recent algebraic-geometric framework that studies the unique recovery of points in a linear subspace from their images under a given collection of linear maps. It has been successful in interpreting such a recovery in the case of permutations composed by coordinate projections, an important instance in applications known as unlabeled sensing, which models data that are out of order and have missing values. In this paper, we provide tighter and simpler conditions that guarantee the unique recovery for the single-subspace case, extend the result to the case of a subspace arrangement, and show that the unique recovery in a single subspace is locally stable under noise. We specialize our results to several examples of homomorphic sensing such as real phase retrieval and unlabeled sensing. In so doing, in a unified way, we obtain conditions that guarantee the unique recovery for those examples, typically known via diverse techniques in the literature, as well as novel conditions for sparse and unsigned versions of unlabeled sensing. Similarly, our noise result also implies that the unique recovery in unlabeled sensing is locally stable.  ( 3 min )

An effective weighting scheme for training samples is essential for learning tasks. Numerous weighting schemes have been proposed. Some schemes take the easy-first mode, whereas some others take the hard-first one. Naturally, an interesting yet realistic question is raised. Which samples should be learned first given a new learning task, easy or hard? To answer this question, both theoretical analyses and experimental verification are conducted. First, a general optimized objective function is proposed, revealing the relationship between the difficulty distribution and the difficulty-based sample weights. Second, on the basis of the optimized objective function, theoretical answers are obtained. Besides the easy-first and hard-first modes, there are two other priority modes, namely, medium-first and two-ends-first. The prior mode does not necessarily remain unchanged during the training process. Third, an effective and universal solution is proposed to select the optimal priority mode when there is no prior knowledge or theoretical clues. The four modes, namely, easy/medium/hard/two-ends-first, can be flexibly switched in the proposed solution. Fourth, a wide range of experiments is conducted under various scenarios to further compare the weighting schemes in different modes. On the basis of these works, reasonable and comprehensive answers are obtained. Factors including the distribution of samples' learning difficulties and the validation data determine which samples should be learned first in a learning task.  ( 3 min )

Principal Component Analysis (PCA) minimizes the reconstruction error given a class of linear models of fixed component dimensionality. Probabilistic PCA adds a probabilistic structure by learning the probability distribution of the PCA latent space weights, thus creating a generative model. Autoencoders (AE) minimize the reconstruction error in a class of nonlinear models of fixed latent space dimensionality and outperform PCA at fixed dimensionality. Here, we introduce the Probabilistic Autoencoder (PAE) that learns the probability distribution of the AE latent space weights using a normalizing flow (NF). The PAE is fast and easy to train and achieves small reconstruction errors, high sample quality, and good performance in downstream tasks. We compare the PAE to Variational AE (VAE), showing that the PAE trains faster, reaches a lower reconstruction error, and produces good sample quality without requiring special tuning parameters or training procedures. We further demonstrate that the PAE is a powerful model for performing the downstream tasks of probabilistic image reconstruction in the context of Bayesian inference of inverse problems for inpainting and denoising applications. Finally, we identify latent space density from NF as a promising outlier detection metric.

The staple of human intelligence is the capability of acquiring knowledge in a continuous fashion. In stark contrast, Deep Networks forget catastrophically and, for this reason, the sub-field of Class-Incremental Continual Learning fosters methods that learn a sequence of tasks incrementally, blending sequentially-gained knowledge into a comprehensive prediction. This work aims at assessing and overcoming the pitfalls of our previous proposal Dark Experience Replay (DER), a simple and effective approach that combines rehearsal and Knowledge Distillation. Inspired by the way our minds constantly rewrite past recollections and set expectations for the future, we endow our model with the abilities to i) revise its replay memory to welcome novel information regarding past data ii) pave the way for learning yet unseen classes. We show that the application of these strategies leads to remarkable improvements; indeed, the resulting method - termed eXtended-DER (X-DER) - outperforms the state of the art on both standard benchmarks (such as CIFAR-100 and miniImagenet) and a novel one here introduced. To gain a better understanding, we further provide extensive ablation studies that corroborate and extend the findings of our previous research (e.g. the value of Knowledge Distillation and flatter minima in continual learning setups).

The autism dataset is studied to identify the differences between autistic and healthy groups. For this, the resting-state Functional Magnetic Resonance Imaging (rs-fMRI) data of the two groups are analyzed, and networks of connections between brain regions were created. Several classification frameworks are developed to distinguish the connectivity patterns between the groups. The best models for statistical inference and precision were compared, and the tradeoff between precision and model interpretability was analyzed. Finally, the classification accuracy measures were reported to justify the performance of our framework. Our best model can classify autistic and healthy patients on the multisite ABIDE I data with 71% accuracy.

When training overparameterized deep networks for classification tasks, it has been widely observed that the learned features exhibit a so-called "neural collapse" phenomenon. More specifically, for the output features of the penultimate layer, for each class the within-class features converge to their means, and the means of different classes exhibit a certain tight frame structure, which is also aligned with the last layer's classifier. As feature normalization in the last layer becomes a common practice in modern representation learning, in this work we theoretically justify the neural collapse phenomenon for normalized features. Based on an unconstrained feature model, we simplify the empirical loss function in a multi-class classification task into a nonconvex optimization problem over the Riemannian manifold by constraining all features and classifiers over the sphere. In this context, we analyze the nonconvex landscape of the Riemannian optimization problem over the product of spheres, showing a benign global landscape in the sense that the only global minimizers are the neural collapse solutions while all other critical points are strict saddles with negative curvature. Experimental results on practical deep networks corroborate our theory and demonstrate that better representations can be learned faster via feature normalization.

We study the convergence properties, in Hellinger and related distances, of nonparametric density estimators based on measure transport. These estimators represent the measure of interest as the pushforward of a chosen reference distribution under a transport map, where the map is chosen via a maximum likelihood objective (equivalently, minimizing an empirical Kullback-Leibler loss) or a penalized version thereof. We establish concentration inequalities for a general class of penalized measure transport estimators, by combining techniques from M-estimation with analytical properties of the transport-based density representation. We then demonstrate the implications of our theory for the case of triangular Knothe-Rosenblatt (KR) transports on the $d$-dimensional unit cube, and show that both penalized and unpenalized versions of such estimators achieve minimax optimal convergence rates over H\"older classes of densities. Specifically, we establish optimal rates for unpenalized nonparametric maximum likelihood estimation over bounded H\"older-type balls, and then for certain Sobolev-penalized estimators and sieved wavelet estimators.

Node clustering is a powerful tool in the analysis of networks. We introduce a graph neural network framework to obtain node embeddings for directed networks in a self-supervised manner, including a novel probabilistic imbalance loss, which can be used for network clustering. Here, we propose directed flow imbalance measures, which are tightly related to directionality, to reveal clusters in the network even when there is no density difference between clusters. In contrast to standard approaches in the literature, in this paper, directionality is not treated as a nuisance, but rather contains the main signal. DIGRAC optimizes directed flow imbalance for clustering without requiring label supervision, unlike existing graph neural network methods, and can naturally incorporate node features, unlike existing spectral methods. Extensive experimental results on synthetic data, in the form of directed stochastic block models, and real-world data at different scales, demonstrate that our method, based on flow imbalance, attains state-of-the-art results on directed graph clustering when compared against 10 state-of-the-art methods from the literature, for a wide range of noise and sparsity levels, graph structures and topologies, and even outperforms supervised methods.

This paper presents the HiPart package, an open-source native python library that provides efficient and interpret-able implementations of divisive hierarchical clustering algorithms. HiPart supports interactive visualizations for the manipulation of the execution steps allowing the direct intervention of the clustering outcome. This package is highly suited for Big Data applications as the focus has been given to the computational efficiency of the implemented clustering methodologies. The dependencies used are either Python build-in packages or highly maintained stable external packages. The software is provided under the MIT license. The package's source code and documentation can be found at https://github.com/panagiotisanagnostou/HiPart.

The concept of causality plays an important role in human cognition . In the past few decades, causal inference has been well developed in many fields, such as computer science, medicine, economics, and education. With the advancement of deep learning techniques, it has been increasingly used in causal inference against counterfactual data. Typically, deep causal models map the characteristics of covariates to a representation space and then design various objective optimization functions to estimate counterfactual data unbiasedly based on the different optimization methods. This paper focuses on the survey of the deep causal models, and its core contributions are as follows: 1) we provide relevant metrics under multiple treatments and continuous-dose treatment; 2) we incorporate a comprehensive overview of deep causal models from both temporal development and method classification perspectives; 3) we assist a detailed and comprehensive classification and analysis of relevant datasets and source code.

Subgraph isomorphism or subgraph matching is generally considered as an NP-complete problem, made more complex in practical applications where the edge weights take real values and are subject to measurement noise and possible anomalies. To the best of our knowledge, almost all subgraph matching methods utilize node labels to perform node-node matching. In the absence of such labels (in applications such as image matching and map matching among others), these subgraph matching methods do not work. We propose a method for identifying the node correspondence between a subgraph and a full graph in the inexact case without node labels in two steps - (a) extract the minimal unique topology preserving subset from the subgraph and find its feasible matching in the full graph, and (b) implement a consensus-based algorithm to expand the matched node set by pairing unique paths based on boundary commutativity. Going beyond the existing subgraph matching approaches, the proposed method is shown to have realistically sub-linear computational efficiency, robustness to random measurement noise, and good statistical properties. Our method is also readily applicable to the exact matching case without loss of generality. To demonstrate the effectiveness of the proposed method, a simulation and a case study is performed on the Erdos-Renyi random graphs and the image-based affine covariant features dataset respectively.

Causal discovery for quantitative data has been extensively studied but less is known for categorical data. We propose a novel causal model for categorical data based on a new classification model, termed classification with optimal label permutation (COLP). By design, COLP is a parsimonious classifier, which gives rise to a provably identifiable causal model. A simple learning algorithm via comparing likelihood functions of causal and anti-causal models suffices to learn the causal direction. Through experiments with synthetic and real data, we demonstrate the favorable performance of the proposed COLP-based causal model compared to state-of-the-art methods. We also make available an accompanying R package COLP, which contains the proposed causal discovery algorithm and a benchmark dataset of categorical cause-effect pairs.

The computational prediction of wave propagation in dam-break floods is a long-standing problem in hydrodynamics and hydrology. Until now, conventional numerical models based on Saint-Venant equations are the dominant approaches. Here we show that a machine learning model that is well-trained on a minimal amount of data, can help predict the long-term dynamic behavior of a one-dimensional dam-break flood with satisfactory accuracy. For this purpose, we solve the Saint-Venant equations for a one-dimensional dam-break flood scenario using the Lax-Wendroff numerical scheme and train the reservoir computing echo state network (RC-ESN) with the dataset by the simulation results consisting of time-sequence flow depths. We demonstrate a good prediction ability of the RC-ESN model, which ahead predicts wave propagation behavior 286 time-steps in the dam-break flood with a root mean square error (RMSE) smaller than 0.01, outperforming the conventional long short-term memory (LSTM) model which reaches a comparable RMSE of only 81 time-steps ahead. To show the performance of the RC-ESN model, we also provide a sensitivity analysis of the prediction accuracy concerning the key parameters including training set size, reservoir size, and spectral radius. Results indicate that the RC-ESN are less dependent on the training set size, a medium reservoir size K=1200~2600 is sufficient. We confirm that the spectral radius \r{ho} shows a complex influence on the prediction accuracy and suggest a smaller spectral radius \r{ho} currently. By changing the initial flow depth of the dam break, we also obtained the conclusion that the prediction horizon of RC-ESN is larger than that of LSTM.

The minimum sum-of-squares clustering (MSSC), or k-means type clustering, has been recently extended to exploit prior knowledge on the cardinality of each cluster. Such knowledge is used to increase performance as well as solution quality. In this paper, we propose an exact approach based on the branch-and-cut technique to solve the cardinality-constrained MSSC. For the lower bound routine, we use the semidefinite programming (SDP) relaxation recently proposed by Rujeerapaiboon et al. [SIAM J. Optim. 29(2), 1211-1239, (2019)]. However, this relaxation can be used in a branch-and-cut method only for small-size instances. Therefore, we derive a new SDP relaxation that scales better with the instance size and the number of clusters. In both cases, we strengthen the bound by adding polyhedral cuts. Benefiting from a tailored branching strategy which enforces pairwise constraints, we reduce the complexity of the problems arising in the children nodes. For the upper bound, instead, we present a local search procedure that exploits the solution of the SDP relaxation solved at each node. Computational results show that the proposed algorithm globally solves, for the first time, real-world instances of size 10 times larger than those solved by state-of-the-art exact methods.

\cite{rohe2016co} proposed Stochastic co-Blockmodel (ScBM) as a tool for detecting community structure of binary directed graph data in network studies. However, ScBM completely ignores node weight, and is unable to explain the block structure of directed weighted network which appears in various areas, such as biology, sociology, physiology and computer science. Here, to model directed weighted network, we introduce a Directed Distribution-Free model by releasing ScBM's distribution restriction. We also build an extension of the proposed model by considering variation of node degree. Our models do not require a specific distribution on generating elements of adjacency matrix but only a block structure on the expected adjacency matrix. Spectral algorithms with theoretical guarantee on consistent estimation of node label are presented to identify communities. Our proposed methods are illustrated by simulated and empirical examples.  ( 2 min )

Machine unlearning is a process of removing the impact of some training data from the machine learning (ML) models upon receiving removal requests. While straightforward and legitimate, retraining the ML model from scratch incurs a high computational overhead. To address this issue, a number of approximate algorithms have been proposed in the domain of image and text data, among which SISA is the state-of-the-art solution. It randomly partitions the training set into multiple shards and trains a constituent model for each shard. However, directly applying SISA to the graph data can severely damage the graph structural information, and thereby the resulting ML model utility. In this paper, we propose GraphEraser, a novel machine unlearning framework tailored to graph data. Its contributions include two novel graph partition algorithms and a learning-based aggregation method. We conduct extensive experiments on five real-world graph datasets to illustrate the unlearning efficiency and model utility of GraphEraser. It achieves 2.06$\times$ (small dataset) to 35.94$\times$ (large dataset) unlearning time improvement. On the other hand, GraphEraser achieves up to $62.5\%$ higher F1 score and our proposed learning-based aggregation method achieves up to $112\%$ higher F1 score.\footnote{Our code is available at \url{https://github.com/MinChen00/Graph-Unlearning}.}  ( 3 min )

In the pursuit of explaining implicit regularization in deep learning, prominent focus was given to matrix and tensor factorizations, which correspond to simplified neural networks. It was shown that these models exhibit an implicit tendency towards low matrix and tensor ranks, respectively. Drawing closer to practical deep learning, the current paper theoretically analyzes the implicit regularization in hierarchical tensor factorization, a model equivalent to certain deep convolutional neural networks. Through a dynamical systems lens, we overcome challenges associated with hierarchy, and establish implicit regularization towards low hierarchical tensor rank. This translates to an implicit regularization towards locality for the associated convolutional networks. Inspired by our theory, we design explicit regularization discouraging locality, and demonstrate its ability to improve the performance of modern convolutional networks on non-local tasks, in defiance of conventional wisdom by which architectural changes are needed. Our work highlights the potential of enhancing neural networks via theoretical analysis of their implicit regularization.  ( 3 min )

Networks are ubiquitous in many real-world applications (e.g., social networks encoding trust/distrust relationships, correlation networks arising from time series data). While many networks are signed or directed, or both, there is a lack of unified software packages on graph neural networks (GNNs) specially designed for signed and directed networks. In this paper, we present PyTorch Geometric Signed Directed, a software package which fills this gap. Along the way, we also provide a brief review surveying typical tasks, loss functions and evaluation metrics in the analysis of signed and directed networks, discuss data used in related experiments, provide an overview of methods proposed, and evaluate the implemented methods with experiments. The deep learning framework consists of easy-to-use GNN models, synthetic and real-world data, as well as task-specific evaluation metrics and loss functions for signed and directed networks. As an extension library for PyTorch Geometric, our proposed software is maintained with open-source releases, detailed documentation, continuous integration, unit tests and code coverage checks. Our code is publicly available at \url{https://github.com/SherylHYX/pytorch_geometric_signed_directed}.  ( 3 min )

Mixtures of experts (MoE) models are a popular framework for modeling heterogeneity in data, for both regression and classification problems in statistics and machine learning, due to their flexibility and the abundance of available statistical estimation and model choice tools. Such flexibility comes from allowing the mixture weights (or gating functions) in the MoE model to depend on the explanatory variables, along with the experts (or component densities). This permits the modeling of data arising from more complex data generating processes when compared to the classical finite mixtures and finite mixtures of regression models, whose mixing parameters are independent of the covariates. The use of MoE models in a high-dimensional setting, when the number of explanatory variables can be much larger than the sample size, is challenging from a computational point of view, and in particular from a theoretical point of view, where the literature is still lacking results for dealing with the curse of dimensionality, for both the statistical estimation and feature selection problems. We consider the finite MoE model with soft-max gating functions and Gaussian experts for high-dimensional regression on heterogeneous data, and its $l_1$-regularized estimation via the Lasso. We focus on the Lasso estimation properties rather than its feature selection properties. We provide a lower bound on the regularization parameter of the Lasso function that ensures an $l_1$-oracle inequality satisfied by the Lasso estimator according to the Kullback--Leibler loss.

Purpose: We perform anatomical landmarking for craniomaxillofacial (CMF) bones without explicitly segmenting them. Towards this, we propose a new simple yet efficient deep network architecture, called \textit{relational reasoning network (RRN)}, to accurately learn the local and the global relations among the landmarks in CMF bones; specifically, mandible, maxilla, and nasal bones. Approach: The proposed RRN works in an end-to-end manner, utilizing learned relations of the landmarks based on dense-block units. For a given few landmarks as input, RRN treats the landmarking process similar to a data imputation problem where predicted landmarks are considered missing. Results: We applied RRN to cone beam computed tomography scans obtained from 250 patients. With a 4-fold cross validation technique, we obtained an average root mean squared error of less than 2 mm per landmark. Our proposed RRN has revealed unique relationships among the landmarks that help us in inferring several \textit{reasoning} about informativeness of the landmark points. The proposed system identifies the missing landmark locations accurately even when severe pathology or deformation are present in the bones. Conclusions: Accurately identifying anatomical landmarks is a crucial step in deformation analysis and surgical planning for CMF surgeries. Achieving this goal without the need for explicit bone segmentation addresses a major limitation of segmentation based approaches, where segmentation failure (as often the case in bones with severe pathology or deformation) could easily lead to incorrect landmarking. To the best of our knowledge, this is the first of its kind algorithm finding anatomical relations of the objects using deep learning.  ( 3 min )

We consider the batch (off-line) policy learning problem in the infinite horizon Markov Decision Process. Motivated by mobile health applications, we focus on learning a policy that maximizes the long-term average reward. We propose a doubly robust estimator for the average reward and show that it achieves semiparametric efficiency. Further we develop an optimization algorithm to compute the optimal policy in a parameterized stochastic policy class. The performance of the estimated policy is measured by the difference between the optimal average reward in the policy class and the average reward of the estimated policy and we establish a finite-sample regret guarantee. The performance of the method is illustrated by simulation studies and an analysis of a mobile health study promoting physical activity.  ( 2 min )

In this paper, we study the statistical limits in terms of Sobolev norms of gradient descent for solving inverse problem from randomly sampled noisy observations using a general class of objective functions. Our class of objective functions includes Sobolev training for kernel regression, Deep Ritz Methods (DRM), and Physics Informed Neural Networks (PINN) for solving elliptic partial differential equations (PDEs) as special cases. We consider a potentially infinite-dimensional parameterization of our model using a suitable Reproducing Kernel Hilbert Space and a continuous parameterization of problem hardness through the definition of kernel integral operators. We prove that gradient descent over this objective function can also achieve statistical optimality and the optimal number of passes over the data increases with sample size. Based on our theory, we explain an implicit acceleration of using a Sobolev norm as the objective function for training, inferring that the optimal number of epochs of DRM becomes larger than the number of PINN when both the data size and the hardness of tasks increase, although both DRM and PINN can achieve statistical optimality.  ( 3 min )

Leave-one-out cross-validation (LOO-CV) is a popular method for estimating out-of-sample predictive accuracy. However, computing LOO-CV criteria can be computationally expensive due to the need to fit the model multiple times. In the Bayesian context, importance sampling provides a possible solution but classical approaches can easily produce estimators whose variance is infinite, making them potentially unreliable. Here we propose and analyze a novel mixture estimator to compute Bayesian LOO-CV criteria. Our method retains the simplicity and computational convenience of classical approaches, while guaranteeing finite variance of the resulting estimators. Both theoretical and numerical results are provided to illustrate the improved robustness and efficiency. The computational benefits are particularly significant in high-dimensional problems, allowing to perform Bayesian LOO-CV for a broader range of models. The proposed methodology is easily implementable in standard probabilistic programming software and has a computational cost roughly equivalent to fitting the original model once.  ( 2 min )

In semiconductor manufacturing, wafer map defect pattern provides critical information for facility maintenance and yield management, so the classification of defect patterns is one of the most important tasks in the manufacturing process. In this paper, we propose a novel way to represent the shape of the defect pattern as a finite-dimensional vector, which will be used as an input for a neural network algorithm for classification. The main idea is to extract the topological features of each pattern by using the theory of persistent homology from topological data analysis (TDA). Through some experiments with a simulated dataset, we show that the proposed method is faster and much more efficient in training with higher accuracy, compared with the method using convolutional neural networks (CNN) which is the most common approach for wafer map defect pattern classification. Moreover, our method outperforms the CNN-based method when the number of training data is not enough and is imbalanced.  ( 2 min )

Federated learning learns a neural network model by aggregating the knowledge from a group of distributed clients under the privacy-preserving constraint. In this work, we show that this paradigm might inherit the adversarial vulnerability of the centralized neural network, i.e., it has deteriorated performance on adversarial examples when the model is deployed. This is even more alarming when federated learning paradigm is designed to approximate the updating behavior of a centralized neural network. To solve this problem, we propose an adversarially robust federated learning framework, named Fed_BVA, with improved server and client update mechanisms. This is motivated by our observation that the generalization error in federated learning can be naturally decomposed into the bias and variance triggered by multiple clients' predictions. Thus, we propose to generate the adversarial examples via maximizing the bias and variance during server update, and learn the adversarially robust model updates with those examples during client update. As a result, an adversarially robust neural network can be aggregated from these improved local clients' model updates. The experiments are conducted on multiple benchmark data sets using several prevalent neural network models, and the empirical results show that our framework is robust against white-box and black-box adversarial corruptions under both IID and non-IID settings.  ( 3 min )

In this paper, we propose a new covering technique localized for the trajectories of SGD. This localization provides an algorithm-specific complexity measured by the covering number, which can have dimension-independent cardinality in contrast to standard uniform covering arguments that result in exponential dimension dependency. Based on this localized construction, we show that if the objective function is a finite perturbation of a piecewise strongly convex and smooth function with $P$ pieces, i.e. non-convex and non-smooth in general, the generalization error can be upper bounded by $O(\sqrt{(\log n\log(nP))/n})$, where $n$ is the number of data samples. In particular, this rate is independent of dimension and does not require early stopping and decaying step size. Finally, we employ these results in various contexts and derive generalization bounds for multi-index linear models, multi-class support vector machines, and $K$-means clustering for both hard and soft label setups, improving the known state-of-the-art rates.  ( 2 min )

This paper studies the fundamental problem of learning energy-based model (EBM) in the latent space of the generator model. Learning such prior model typically requires running costly Markov Chain Monte Carlo (MCMC). Instead, we propose to use noise contrastive estimation (NCE) to discriminatively learn the EBM through density ratio estimation between the latent prior density and latent posterior density. However, the NCE typically fails to accurately estimate such density ratio given large gap between two densities. To effectively tackle this issue and learn more expressive prior models, we develop the adaptive multi-stage density ratio estimation which breaks the estimation into multiple stages and learn different stages of density ratio sequentially and adaptively. The latent prior model can be gradually learned using ratio estimated in previous stage so that the final latent space EBM prior can be naturally formed by product of ratios in different stages. The proposed method enables informative and much sharper prior than existing baselines, and can be trained efficiently. Our experiments demonstrate strong performances in image generation and reconstruction as well as anomaly detection.  ( 2 min )

Two aspects of neural networks that have been extensively studied in the recent literature are their function approximation properties and their training by gradient descent methods. The approximation problem seeks accurate approximations with a minimal number of weights. In most of the current literature these weights are fully or partially hand-crafted, showing the capabilities of neural networks but not necessarily their practical performance. In contrast, optimization theory for neural networks heavily relies on an abundance of weights in over-parametrized regimes. This paper balances these two demands and provides an approximation result for shallow networks in $1d$ with non-convex weight optimization by gradient descent. We consider finite width networks and infinite sample limits, which is the typical setup in approximation theory. Technically, this problem is not over-parametrized, however, some form of redundancy reappears as a loss in approximation rate compared to best possible rates.  ( 2 min )

Deployed machine learning (ML) models often encounter new user data that differs from their training data. Therefore, estimating how well a given model might perform on the new data is an important step toward reliable ML applications. This is very challenging, however, as the data distribution can change in flexible ways, and we may not have any labels on the new data, which is often the case in monitoring settings. In this paper, we propose a new distribution shift model, Sparse Joint Shift (SJS), which considers the joint shift of both labels and a few features. This unifies and generalizes several existing shift models including label shift and sparse covariate shift, where only marginal feature or label distribution shifts are considered. We describe mathematical conditions under which SJS is identifiable. We further propose SEES, an algorithmic framework to characterize the distribution shift under SJS and to estimate a model's performance on new data without any labels. We conduct extensive experiments on several real-world datasets with various ML models. Across different datasets and distribution shifts, SEES achieves significant (up to an order of magnitude) shift estimation error improvements over existing approaches.  ( 2 min )

Deep learning models have shown impressive results in a variety of time series forecasting tasks, where modeling the conditional distribution of the future given the past is the essence. However, when this conditional distribution is non-stationary, it poses challenges for these models to learn consistently and to predict accurately. In this work, we propose a new method to model non-stationary conditional distributions over time by clearly decoupling stationary conditional distribution modeling from non-stationary dynamics modeling. Our method is based on a Bayesian dynamic model that can adapt to conditional distribution changes and a deep conditional distribution model that can handle large multivariate time series using a factorized output space. Our experimental results on synthetic and popular public datasets show that our model can adapt to non-stationary time series better than state-of-the-art deep learning solutions.  ( 2 min )

Capturing the conditional covariances or correlations among the elements of a multivariate response vector based on covariates is important to various fields including neuroscience, epidemiology and biomedicine. We propose a new method called Covariance Regression with Random Forests (CovRegRF) to estimate the covariance matrix of a multivariate response given a set of covariates, using a random forest framework. Random forest trees are built with a splitting rule specially designed to maximize the difference between the sample covariance matrix estimates of the child nodes. We also propose a significance test for the partial effect of a subset of covariates. We evaluate the performance of the proposed method and significance test through a simulation study which shows that the proposed method provides accurate covariance matrix estimates and that the Type-1 error is well controlled. We also demonstrate an application of the proposed method with a thyroid disease data set.  ( 2 min )

As a tool for estimating networks in high dimensions, graphical models are commonly applied to calcium imaging data to estimate functional neuronal connectivity, i.e. relationships between the activities of neurons. However, in many calcium imaging data sets, the full population of neurons is not recorded simultaneously, but instead in partially overlapping blocks. This leads to the Graph Quilting problem, as first introduced by (Vinci et.al. 2019), in which the goal is to infer the structure of the full graph when only subsets of features are jointly observed. In this paper, we study a novel two-step approach to Graph Quilting, which first imputes the complete covariance matrix using low-rank covariance completion techniques before estimating the graph structure. We introduce three approaches to solve this problem: block singular value decomposition, nuclear norm penalization, and non-convex low-rank factorization. While prior works have studied low-rank matrix completion, we address the challenges brought by the block-wise missingness and are the first to investigate the problem in the context of graph learning. We discuss theoretical properties of the two-step procedure, showing graph selection consistency of one proposed approach by proving novel L infinity-norm error bounds for matrix completion with block-missingness. We then investigate the empirical performance of the proposed methods on simulations and on real-world data examples, through which we show the efficacy of these methods for estimating functional connectivity from calcium imaging data.  ( 3 min )

Bayesian variable selection methods are powerful techniques for fitting and inferring on sparse high-dimensional linear regression models. However, many are computationally intensive or require restrictive prior distributions on model parameters. Likelihood based penalization methods are more computationally friendly, but resource intensive refitting techniques are needed for inference. In this paper, we proposed an efficient and powerful Bayesian approach for sparse high-dimensional linear regression. Minimal prior assumptions on the parameters are required through the use of plug-in empirical Bayes estimates of hyperparameters. Efficient maximum a posteriori probability (MAP) estimation is completed through the use of a partitioned and extended expectation conditional maximization (ECM) algorithm. The result is a PaRtitiOned empirical Bayes Ecm (PROBE) algorithm applied to sparse high-dimensional linear regression. We propose methods to estimate credible and prediction intervals for predictions of future values. We compare the empirical properties of predictions and our predictive inference to comparable approaches with numerous simulation studies and an analysis of cancer cell lines drug response study. The proposed approach is implemented in the R package probe.  ( 2 min )

Predictions and forecasts of machine learning models should take the form of probability distributions, aiming to increase the quantity of information communicated to end users. Although applications of probabilistic prediction and forecasting with machine learning models in academia and industry are becoming more frequent, related concepts and methods have not been formalized and structured under a holistic view of the entire field. Here, we review the topic of predictive uncertainty estimation with machine learning algorithms, as well as the related metrics (consistent scoring functions and proper scoring rules) for assessing probabilistic predictions. The review covers a time period spanning from the introduction of early statistical (linear regression and time series models, based on Bayesian statistics or quantile regression) to recent machine learning algorithms (including generalized additive models for location, scale and shape, random forests, boosting and deep learning algorithms) that are more flexible by nature. The review of the progress in the field, expedites our understanding on how to develop new algorithms tailored to users' needs, since the latest advancements are based on some fundamental concepts applied to more complex algorithms. We conclude by classifying the material and discussing challenges that are becoming a hot topic of research.  ( 2 min )

We consider the problem of estimating the topology of multiple networks from nodal observations, where these networks are assumed to be drawn from the same (unknown) random graph model. We adopt a graphon as our random graph model, which is a nonparametric model from which graphs of potentially different sizes can be drawn. The versatility of graphons allows us to tackle the joint inference problem even for the cases where the graphs to be recovered contain different number of nodes and lack precise alignment across the graphs. Our solution is based on combining a maximum likelihood penalty with graphon estimation schemes and can be used to augment existing network inference methods. The proposed joint network and graphon estimation is further enhanced with the introduction of a robust method for noisy graph sampling information. We validate our proposed approach by comparing its performance against competing methods in synthetic and real-world datasets.  ( 2 min )

The world is becoming increasingly complex - as highlighted in my first article here - but the concern isn’t only about being complex. Considering the ever-increasing speed of the state of complexity, we have entered the age of polycrisis. The post Living in a Risk Society – Change, Perpetual Crisis, Comprehension, and Policy appeared first on Data Science Central.  ( 21 min )

Business agility is nearly universally acknowledged to be a prime goal for companies looking to make themselves sustainable in the VUCA world in which we currently operate.  Achieving it requires a journey of transformation and continual evolution.  The post Agility and the Third Derivative appeared first on Data Science Central.  ( 22 min )

The problem of data violation is one of the most threatening issues of being on the internet. The ambiguity regarding the collection, usage, and sharing of our personal and sensitive information adds to the insecurity experienced by most consumers. The post How CPRA Will Change the Face of US Businesses appeared first on Data Science Central.  ( 21 min )

Hi, all, I know only a little about various architecture of AIs and Neural networks, but I just had a thought: Is it possible to create an AI built of a few neural networks, where there's (a) main one(s) for whatever the task is, but another neural network as a subsystem for modifying the architecture of the main network itself? So imagine you're trying to make train a network to recognize shapes in doodles, however you start noticing that it's limited in the amount of features it takes into consideration, so it misses some key features that are required to identify specific types of doodles. So you could increase the amount of neurons in some layers and/or the amount of layers. However, what if another neural network looked at the prediction rate of the previous network and was able to modify it instead of you? Is it possible to do such a thing? How would such an architecture look like? Please be technical in terminology with me, I'm sure I don't know lots of things and using the right terms will help me be aware of them and that way go learn about them so I can improve my understanding of these ideas and you're saying. submitted by /u/GalGreenfield [link] [comments]  ( 88 min )

Thanks submitted by /u/AlternativeDish5596 [link] [comments]  ( 88 min )

Data science assists SEO experts in countless ways, like personalizing the customer experience, understanding client requirements, and many other things. The post How to Use Data Science for Search Engine Optimization appeared first on Data Science Central.  ( 20 min )

The quintessential example of a digital twin is the wind turbine. A digital twin is a real-time virtual representation of a real-world physical system or process that serves as its digital counterpart of it. Like all models or abstractions, a twin is created for practical purposes i.e. we wish to model a physical system of a phenomenon to understand it better. The post Digital Twins as Building Blocks of the Metaverse appeared first on Data Science Central.  ( 20 min )

Good evening, everyone. I hope everyone is well. We all know that the IT area as a whole, especially in the area of artificial intelligence, has been having almost daily updates about new methodologies, algorithms, tools, etc. How do you keep yourselves updated? In my case, I subscribe to some newsletters in the data area: Data Engineering Podcast Harvard Data Science Review Made With ML MLOps Newsletter Papers With Code The Batch The Variable Some other newsletters I subscribe to, but which are not directly connected to AI: ByteByteGo Medium NVIDIA submitted by /u/barash-616 [link] [comments]  ( 89 min )

Hello! I wanted to share our recent work on understanding & explaining ML models through natural language conversations. We use dialogues as an accesible tool for model understanding, so anyone can "talk" to an ML model to understand it, like its another colleague. We also provide a flexible implementation you can adapt to your models & datasets. Twitter thread: https://twitter.com/dylanslack20/status/1571945003676737537 Paper: https://arxiv.org/abs/2207.04154 Code: https://github.com/dylan-slack/TalkToModel submitted by /u/dylan-slack [link] [comments]  ( 88 min )

Would we be able to achieve a breakthrough if we make a more robust model even though we do not increase the data set or the parameters of the model or would we have to wait until there's a breakthrough made in hardware so that we can play with models that have 1000 trillion parameters like our brains? Is it the problem of hardware or software? And if it is a problem of hardware, is AI really only reserved for the extremely wealthy organizations who can afford to train such a huge model? Was depressed after realizing that GPT-3 is not opensource and I need to pay a huge amount of $$ to use their API and that it would be impossible for me, a college student, to build and train such a huge model only with a laptop. I just wanna build a small chatbot that can have conversation with me... submitted by /u/After_Philosopher572 [link] [comments]  ( 91 min )

This is somewhat random... But I recently remembered that years back when I did Andrew Ng's Coursera course on machine learning I was watching one of his lectures in a library fully immersed in the technicalities when he suddenly dropped some random statement about "mathematicians" and "love" or something that made him and the audience laugh (and me also in the quiet library). Now I am trying to find that part in the lectures, but couldn't until now and I don't want to rewatch the entire thing. I think it's this playlist: https://www.youtube.com/watch?v=UzxYlbK2c7E&list=PLA89DCFA6ADACE599. Anyone know what I am talking about and maybe can pinpoint it to me? submitted by /u/doktorfaustus91 [link] [comments]  ( 89 min )

Good afternoon everyone. I hope you are all well. My advisor and I are planning a course on Reinforcement Learning to teach in our master's program at our university. This will be the first time we are teaching this course, so we have no previous experiences to use as a basis. Context: It is a professional master's program, so the students are inserted into the labor market. The graduate program has 3 lines of research: IT infrastructure; computational intelligence (AI); software engineering. Usually, the courses have students from all 3 research lines, so the intention would be to teach a course that both gives an overview of the area, and gives directions for the AI students to go deeper. What we have already thought about: For now, we only think in the coding context, we will use the following tools: Python; Numpy; JAX; PyTorch; Jupyter Notebook. With this, we intend to make algorithms from scratch (Numpy and JAX) and compare them to the approaches present in PyTorch. We will still have a meeting to decide the topics that will be covered in each class. We will put everything in a repository on GitHub to allow other people to use the materials developed for the course as input. In the future, we are thinking of adapting this course for undergraduate studies. What do you think you can't miss in this course? Which topics do you think are extremely important for a good overview of the area? submitted by /u/barash-616 [link] [comments]  ( 103 min )

Yes, you read the title correctly. This is more of a character study/shitpost testing out Stable Diffusion textual inversion to see how to control it / expected outputs. Turns out, it works better than I thought, and emphasizing/deemphasizing specific terms when using textual inversion works out well. The post also includes a custom inference notebook for multiple inversion concepts. submitted by /u/minimaxir [link] [comments]  ( 89 min )

So I read somewhere that we as humans don't understand what exactly happens in a neural network, we just know that a neuron does something using the biases and the inputs given to it and leads us to a specific output. My question here is, do we understand (mathematically speaking) how X input leads the computer to give Y input? If we don't, then why don't we know it? How does a computer go from an array of input pixels to identifying that this is an upside-down dog (mathematically)? submitted by /u/Skrrubs [link] [comments]  ( 112 min )

TorchStudio 0.9.10 was just released with extensions for all the major Python IDEs (VS Code, PyCharm, Spyder and Sublime Text) by popular request, looking forward for your comments ! One new tutorial and two new videos describe how to use TorchStudio from within your IDE. Download: https://www.torchstudio.ai/download/Full changelog: https://github.com/TorchStudio/torchstudio/releases/tag/0.9.10 If you're new to TorchStudio, here's an introductory tutorial and video: https://www.torchstudio.ai/getstarted/ https://www.youtube.com/watch?v=uvA-ARpKdCA https://preview.redd.it/21tufwslnto91.png?width=3074&format=png&auto=webp&s=802b954254f44b5a737070b300c029457fe58962 submitted by /u/divideconcept [link] [comments]  ( 89 min )

I am struggling to understand the nitty gritty of the diffusion models - what would be the right resource to understand all the maths behind it? submitted by /u/throwaway_reddevil9 [link] [comments]  ( 89 min )

Video: https://youtu.be/xbxe-x6wvRw Yannic Kilcher's summary: Stable Diffusion has been released and is riding a wave of creativity and collaboration. But not everyone is happy about this. This video takes a look at the vibrant open-source community around the model, and its critics. Watch here: https://youtu.be/xbxe-x6wvRw submitted by /u/wei_jok [link] [comments]  ( 91 min )

Hello everyone, I am confronted with a machine learning task where the potential for feature engineering is very large, but so is the space of possible models - which means that it's impossible to try out everything. Do you have a fixed model development workflow for this kind of situation? Do you first do feature engineering on some restricted models, and then move on to do model selection? I am looking something similar to this blog-post (which is a work-flow to train neural networks): A Recipe for Training Neural Networks Thanks for your help! submitted by /u/is_it_learning_yet [link] [comments]  ( 90 min )

Hello, I submitted my first paper to AAAI and phase 1 notification is expected on Sep 27. I'm optimistic, but I keep hearing about lots of noise in the review process. ICLR abstract submission is Sep 21 and the final paper submission is Sep 28. So, can one submit an abstract to ICLR pending AAAI phase 1 notification? That is, can you submit an abstract to ICLR, then withdraw in case of accept and submit in case of reject? Thanks submitted by /u/gideon321 [link] [comments]  ( 88 min )

submitted by /u/hardmaru [link] [comments]  ( 88 min )

Hi everyone I've recently dived into ViTs, and a thought crossed my mind that I was surprised to not find many papers exploring. Special tokens are pretty common in transformer architectures, but they usually play a background role, such as structural (like [BEG], [END], [SEP]) or a placeholder of sorts ([CLS], [MASK]). But I feel like self-attention allows for far more intricate constructs, and theoretically one can create a whole "mini-language" to somehow influence model's behaviour. Is there a particular reason it wouldn't work? Are there any papers that do something similar? The only thing I've found is the recently published DyTox, but it just uses single task tokens for task selection. Also there are the Image+Text models like CoCa that just combine the patches with actual natural language, but I'm interested in something more focused. Here's a toy example that works pretty well: Input: an image of 6 EMNIST characters in a row a left/right direction token an argument token denoting one of the characters in the image e.g. "here's an image depicting 'A 5 H Z T 4', which character is to the left of Z?" Output: The character class of the answer, e.g. "H" in this example Here you can essentially create a domain-specific language out of learnable direction and argument tokens alongside the usual ViT patch embeddings, and it works pretty well, even generalizing to neighboring pairs that it haven't seen in the training dataset (something that didn't work well with "dumber" models). Is there just no popular usecase for something like this? submitted by /u/McAvagr [link] [comments]  ( 89 min )

I'm trying to do an excersive for my ML class, where I have to do lineal regresion with regularization, with either Lasso or Ridge. Doing it with an iterative method, updating the weights, I have no idea how to actually do it. Considering this are the augmented error measurements for Lasso and Ridge, I know I have to calculate the gradient, and (I think?) then the update rule becomes: w_new = w_old - (gradient of E_aug). But I'm not actually sure, and even more so, I wouldn't know how to compute the gradient itself, especially for Lasso. submitted by /u/JavoUruguayo [link] [comments]  ( 89 min )

submitted by /u/gwern [link] [comments]  ( 87 min )

Hello, ​ Could someone suggest me a good link that has DQN code for Cartpole, using the Keras API. I just spent the entire day looking for codes and most have some sort of bugs. ​ The most common bug I find is, that they confuse DQN and DDQN, by just implementing the target network for the latter. submitted by /u/Academic-Rent7800 [link] [comments]  ( 108 min )

I'm trying to train a DQN Agent to play a (not very) simple game. I'm still new to RL but I have some experience with ML and programming in general so I'm trying to come up with different methods to improve the training time of my model that do not necessarily affect the model itself but also the data representation and the training process itself. The game is simple because generally there are "obvious" optimal states that the agent should try to get to. This gave me an idea to try and start with those obvious and easy states so that the agent can quickly learn that those states can lead to a high rewards. I would then gradually, over many episodes, "increase the difficulty" and let the agent figure how to get to those states. submitted by /u/Gonumen [link] [comments]  ( 105 min )

submitted by /u/gwern [link] [comments]  ( 87 min )

What are some last year examples of the most advanced insights on the Turing Test area? submitted by /u/aladoconpapas [link] [comments]  ( 91 min )

submitted by /u/gvij [link] [comments]  ( 87 min )

All the mainstream once’s (Siri, Alexa,google home) feel much more like rule based chatbots. I was hoping there was something that felt more natural? Has anyone tried mycroft? submitted by /u/Kinghonk69 [link] [comments]  ( 87 min )

submitted by /u/FinneanCosgra [link] [comments]  ( 86 min )

submitted by /u/Futures_Bot [link] [comments]  ( 90 min )

submitted by /u/Swisheater [link] [comments]  ( 87 min )

submitted by /u/OceanicFeel [link] [comments]  ( 87 min )

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Hello, Stable Diffusion is a great text to image alternative to DALL-E 2 and MidJourney. But if you are a beginner you will quickly realize that creating the right request to generate great images is not necessarily easy. In general, such requests are quite intuitive, but for the most advanced results you might need to use a couple of tricks. Which is why I wrote this quick guide: https://nlpcloud.com/effectively-using-text-to-image-with-stable-diffusion-dalle-2-alternative.html I hope it will be useful! And if you are aware of some nice techniques that are missing in this article, please let me know! Julien submitted by /u/juliensalinas [link] [comments]  ( 87 min )

The title says it. I left the Stable diffusion subreddit because everyone posted mildly but mostly not so interesting AI-generated images. Seeing this subreddit start to receive lots of these as crossposts. submitted by /u/jetstros [link] [comments]  ( 90 min )

submitted by /u/dream_casting [link] [comments]  ( 87 min )

Is there any AI model that does this? submitted by /u/Xie_Bot [link] [comments]  ( 87 min )

submitted by /u/prfitofthesngularity [link] [comments]  ( 87 min )

The ISO 3166-1 standard defines three codes for each country: a 2-letter abbreviation, a 3-letter abbreviation, and a 3-digit code. The 2-letter abbreviations may be familiar because it is very often (but not always [1]) also the country code top-level domain (ccTLD). For example, AU is the ISO abbreviation for Australia, and .au is the […] Two-letter vs Three-letter Country Abbreviations first appeared on John D. Cook.  ( 5 min )

A week ago I posted some pairs of similar flags on Twitter, and later I found that Mathematica’s CountryData database contains flag descriptions. So I thought I’d use the flag descriptions to see which flags Mathematica things are similar. For example, the FlagDescription attribute for Chad in Mathematica is Three equal vertical bands of blue […] Finding similar world flags with Mathematica first appeared on John D. Cook.  ( 5 min )

Last year, we announced the general availability of RStudio on Amazon SageMaker, the industry’s first fully managed RStudio Workbench integrated development environment (IDE) in the cloud. You can quickly launch the familiar RStudio IDE, and dial up and down the underlying compute resources without interrupting your work, making it easy to build machine learning (ML) […]  ( 7 min )

As AI becomes more deeply integrated into every aspect of our lives, it is essential that AI systems perform appropriately for their intended use. We know AI models can never be perfect, so how do we decide when AI performance is ‘good enough’ for use in a real life application? Is level of accuracy a […] The post AI Models vs. AI Systems: Understanding Units of Performance Assessment appeared first on Microsoft Research.  ( 12 min )

There have been startups that have survived, and there have been startups that have failed. However, what makes one startup succeed over…  ( 10 min )

To regulate the distribution shift experience by learning-based controllers, we seek a mechanism for constraining the agent to regions of high data density throughout its trajectory (left). Here, we present an approach which achieves this goal by combining features of density models (middle) and Lyapunov functions (right). In order to make use of machine learning and reinforcement learning in controlling real world systems, we must design algorithms which not only achieve good performance, but also interact with the system in a safe and reliable manner. Most prior work on safety-critical control focuses on maintaining the safety of the physical system, e.g. avoiding falling over for legged robots, or colliding into obstacles for autonomous vehicles. However, for learning-based controlle…  ( 7 min )

Training deep neural networks often forces users to work in a distributed or outsourced setting, accompanied with privacy concerns. Split learning aims to address this concern by distributing the model among a client and a server. The scheme supposedly provides privacy, since the server cannot see the clients' models and inputs. We show that this is not true via two novel attacks. (1) We show that an honest-but-curious split learning server, equipped only with the knowledge of the client neural network architecture, can recover the input samples and obtain a functionally similar model to the client model, without being detected. (2) We show that if the client keeps hidden only the output layer of the model to "protect" the private labels, the honest-but-curious server can infer the labels with perfect accuracy. We test our attacks using various benchmark datasets and against proposed privacy-enhancing extensions to split learning. Our results show that plaintext split learning can pose serious risks, ranging from data (input) privacy to intellectual property (model parameters), and provide no more than a false sense of security.

In this paper, we investigate properties and performance of synthetic random graph models with a built-in community structure. Such models are important for evaluating and tuning community detection algorithms that are unsupervised by nature. We propose ABCDe, a multi-threaded implementation of the ABCD (Artificial Benchmark for Community Detection) graph generator. We discuss the implementation details of the algorithm and compare it with both the previously available sequential version of the ABCD model and with the parallel implementation of the standard and extensively used LFR (Lancichinetti--Fortunato--Radicchi) generator. We show that ABCDe is more than ten times faster and scales better than the parallel implementation of LFR provided in NetworKit. Moreover, the algorithm is not only faster but random graphs generated by ABCD have similar properties to the ones generated by the original LFR algorithm, while the parallelized NetworKit implementation of LFR produces graphs that have noticeably different characteristics.

Recently, Deep Neural Networks (DNNs) have been widely introduced into Collaborative Filtering (CF) to produce more accurate recommendation results due to their capability of capturing the complex nonlinear relationships between items and users.However, the DNNs-based models usually suffer from high computational complexity, i.e., consuming very long training time and storing huge amount of trainable parameters. To address these problems, we propose a new broad recommender system called Broad Collaborative Filtering (BroadCF), which is an efficient nonlinear collaborative filtering approach. Instead of DNNs, Broad Learning System (BLS) is used as a mapping function to learn the complex nonlinear relationships between users and items, which can avoid the above issues while achieving very satisfactory recommendation performance. However, it is not feasible to directly feed the original rating data into BLS. To this end, we propose a user-item rating collaborative vector preprocessing procedure to generate low-dimensional user-item input data, which is able to harness quality judgments of the most similar users/items. Extensive experiments conducted on seven benchmark datasets have confirmed the effectiveness of the proposed BroadCF algorithm

Neural tangent kernel (NTK) is a powerful tool to analyze training dynamics of neural networks and their generalization bounds. The study on NTK has been devoted to typical neural network architectures, but is incomplete for neural networks with Hadamard products (NNs-Hp), e.g., StyleGAN and polynomial neural networks. In this work, we derive the finite-width NTK formulation for a special class of NNs-Hp, i.e., polynomial neural networks. We prove their equivalence to the kernel regression predictor with the associated NTK, which expands the application scope of NTK. Based on our results, we elucidate the separation of PNNs over standard neural networks with respect to extrapolation and spectral bias. Our two key insights are that when compared to standard neural networks, PNNs are able to fit more complicated functions in the extrapolation regime and admit a slower eigenvalue decay of the respective NTK. Besides, our theoretical results can be extended to other types of NNs-Hp, which expand the scope of our work. Our empirical results validate the separations in broader classes of NNs-Hp, which provide a good justification for a deeper understanding of neural architectures.

Variational Autoencoders (VAEs) have recently been highly successful at imputing and acquiring heterogeneous missing data. However, within this specific application domain, existing VAE methods are restricted by using only one layer of latent variables and strictly Gaussian posterior approximations. To address these limitations, we present HH-VAEM, a Hierarchical VAE model for mixed-type incomplete data that uses Hamiltonian Monte Carlo with automatic hyper-parameter tuning for improved approximate inference. Our experiments show that HH-VAEM outperforms existing baselines in the tasks of missing data imputation and supervised learning with missing features. Finally, we also present a sampling-based approach for efficiently computing the information gain when missing features are to be acquired with HH-VAEM. Our experiments show that this sampling-based approach is superior to alternatives based on Gaussian approximations.

Functional Electrical Stimulation (FES) is a technique to evoke muscle contraction through low-energy electrical signals. FES can animate paralysed limbs. Yet, an open challenge remains on how to apply FES to achieve desired movements. This challenge is accentuated by the complexities of human bodies and the non-stationarities of the muscles' responses. The former causes difficulties in performing inverse dynamics, and the latter causes control performance to degrade over extended periods of use. Here, we engage the challenge via a data-driven approach. Specifically, we learn to control FES through Reinforcement Learning (RL) which can automatically customise the stimulation for the patients. However, RL typically has Markovian assumptions while FES control systems are non-Markovian because of the non-stationarities. To deal with this problem, we use a recurrent neural network to create Markovian state representations. We cast FES controls into RL problems and train RL agents to control FES in different settings in both simulations and the real world. The results show that our RL controllers can maintain control performances over long periods and have better stimulation characteristics than PID controllers.

5G cellular systems depend on the timely exchange of feedback control information between the user equipment and the base station. Proper decoding of this control information is necessary to set up and sustain high throughput radio links. This paper makes the first attempt at using Machine Learning techniques to improve the decoding performance of the Physical Uplink Control Channel Format 0. We use fully connected neural networks to classify the received samples based on the uplink control information content embedded within them. The trained neural network, tested on real-time wireless captures, shows significant improvement in accuracy over conventional DFT-based decoders, even at low SNR. The obtained accuracy results also demonstrate conformance with 3GPP requirements.

In this paper, we propose a new zero order optimization method called minibatch stochastic three points (MiSTP) method to solve an unconstrained minimization problem in a setting where only an approximation of the objective function evaluation is possible. It is based on the recently proposed stochastic three points (STP) method (Bergou et al., 2020). At each iteration, MiSTP generates a random search direction in a similar manner to STP, but chooses the next iterate based solely on the approximation of the objective function rather than its exact evaluations. We also analyze our method's complexity in the nonconvex and convex cases and evaluate its performance on multiple machine learning tasks.

In recent years, the power demonstrated by Machine Learning (ML) has increasingly attracted the interest of the optimization community that is starting to leverage ML for enhancing and automating the design of algorithms. One combinatorial optimization problem recently tackled with ML is the Job Shop scheduling Problem (JSP). Most of the works on the JSP using ML focus on Deep Reinforcement Learning (DRL), and only a few of them leverage supervised learning techniques. The recurrent reasons for avoiding supervised learning seem to be the difficulty in casting the right learning task, i.e., what is meaningful to predict, and how to obtain labels. Therefore, we first propose a novel supervised learning task that aims at predicting the quality of machine permutations. Then, we design an original methodology to estimate this quality, and we use these estimations to create an accurate sequential deep learning model (binary accuracy above 95%). Finally, we empirically demonstrate the value of predicting the quality of machine permutations by enhancing the performance of a simple Tabu Search algorithm inspired by the works in the literature.

We apply methods of machine-learning, such as neural networks, manifold learning and image processing, in order to study 2-dimensional amoebae in algebraic geometry and string theory. With the help of embedding manifold projection, we recover complicated conditions obtained from so-called lopsidedness. For certain cases it could even reach $\sim99\%$ accuracy, in particular for the lopsided amoeba of $F_0$ with positive coefficients which we place primary focus. Using weights and biases, we also find good approximations to determine the genus for an amoeba at lower computational cost. In general, the models could easily predict the genus with over $90\%$ accuracies. With similar techniques, we also investigate the membership problem, and image processing of the amoebae directly.

We present an effective GNN-based knowledge graph embedding model, named WGE, to capture entity- and relation-focused graph structures. In particular, given the knowledge graph, WGE builds a single undirected entity-focused graph that views entities as nodes. In addition, WGE also constructs another single undirected graph from relation-focused constraints, which views entities and relations as nodes. WGE then proposes a GNN-based architecture to better learn vector representations of entities and relations from these two single entity- and relation-focused graphs. WGE feeds the learned entity and relation representations into a weighted score function to return the triple scores for knowledge graph completion. Experimental results show that WGE outperforms competitive baselines, obtaining state-of-the-art performances on seven benchmark datasets for knowledge graph completion.

We study the asymmetric matrix factorization problem under a natural nonconvex formulation with arbitrary overparametrization. The model-free setting is considered, with minimal assumption on the rank or singular values of the observed matrix, where the global optima provably overfit. We show that vanilla gradient descent with small random initialization sequentially recovers the principal components of the observed matrix. Consequently, when equipped with proper early stopping, gradient descent produces the best low-rank approximation of the observed matrix without explicit regularization. We provide a sharp characterization of the relationship between the approximation error, iteration complexity, initialization size and stepsize. Our complexity bound is almost dimension-free and depends logarithmically on the approximation error, with significantly more lenient requirements on the stepsize and initialization compared to prior work. Our theoretical results provide accurate prediction for the behavior gradient descent, showing good agreement with numerical experiments.

Training models on data obtained from randomized experiments is ideal for making good decisions. However, randomized experiments are often time-consuming, expensive, risky, infeasible or unethical to perform, leaving decision makers little choice but to rely on observational data collected under historical policies when training models. This opens questions regarding not only which decision-making policies would perform best in practice, but also regarding the impact of different data collection protocols on the performance of various policies trained on the data, or the robustness of policy performance with respect to changes in problem characteristics such as action- or reward- specific delays in observing outcomes. We aim to answer such questions for the problem of optimizing sales channel allocations at LinkedIn, where sales accounts (leads) need to be allocated to one of three channels, with the goal of maximizing the number of successful conversions over a period of time. A key problem feature constitutes the presence of stochastic delays in observing allocation outcomes, whose distribution is both channel- and outcome- dependent. We built a discrete-time simulation that can handle our problem features and used it to evaluate: a) a historical rule-based policy; b) a supervised machine learning policy (XGBoost); and c) multi-armed bandit (MAB) policies, under different scenarios involving: i) data collection used for training (observational vs randomized); ii) lead conversion scenarios; iii) delay distributions. Our simulation results indicate that LinUCB, a simple MAB policy, consistently outperforms the other policies, achieving a 18-47% lift relative to a rule-based policy

Large pre-trained language models are successfully being used in a variety of tasks, across many languages. With this ever-increasing usage, the risk of harmful side effects also rises, for example by reproducing and reinforcing stereotypes. However, detecting and mitigating these harms is difficult to do in general and becomes computationally expensive when tackling multiple languages or when considering different biases. To address this, we present FairDistillation: a cross-lingual method based on knowledge distillation to construct smaller language models while controlling for specific biases. We found that our distillation method does not negatively affect the downstream performance on most tasks and successfully mitigates stereotyping and representational harms. We demonstrate that FairDistillation can create fairer language models at a considerably lower cost than alternative approaches.

Multi-task learning (MTL) jointly learns a set of tasks by sharing parameters among tasks. It is a promising approach for reducing storage costs while improving task accuracy for many computer vision tasks. The effective adoption of MTL faces two main challenges. The first challenge is to determine what parameters to share across tasks to optimize for both memory efficiency and task accuracy. The second challenge is to automatically apply MTL algorithms to an arbitrary CNN backbone without requiring time-consuming manual re-implementation and significant domain expertise. This paper addresses the challenges by developing the first programming framework AutoMTL that automates efficient MTL model development for vision tasks. AutoMTL takes as inputs an arbitrary backbone convolutional neural network (CNN) and a set of tasks to learn, and automatically produces a multi-task model that achieves high accuracy and small memory footprint simultaneously. Experiments on three popular MTL benchmarks (CityScapes, NYUv2, Tiny-Taskonomy) demonstrate the effectiveness of AutoMTL over state-of-the-art approaches as well as the generalizability of AutoMTL across CNNs. AutoMTL is open-sourced and available at https://github.com/zhanglijun95/AutoMTL.

In order to replace fossil fuels with the use of renewable energy resources, unbalanced resource production of intermittent wind and photovoltaic (PV) power is a critical issue for peer-to-peer (P2P) power trading. To resolve this problem, a reinforcement learning (RL) technique is introduced in this paper. For RL, graph convolutional network (GCN) and bi-directional long short-term memory (Bi-LSTM) network are jointly applied to P2P power trading between nanogrid clusters based on cooperative game theory. The flexible and reliable DC nanogrid is suitable to integrate renewable energy for distribution system. Each local nanogrid cluster takes the position of prosumer, focusing on power production and consumption simultaneously. For the power management of nanogrid clusters, multi-objective optimization is applied to each local nanogrid cluster with the Internet of Things (IoT) technology. Charging/discharging of electric vehicle (EV) is performed considering the intermittent characteristics of wind and PV power production. RL algorithms, such as deep Q-learning network (DQN), deep recurrent Q-learning network (DRQN), Bi-DRQN, proximal policy optimization (PPO), GCN-DQN, GCN-DRQN, GCN-Bi-DRQN, and GCN-PPO, are used for simulations. Consequently, the cooperative P2P power trading system maximizes the profit utilizing the time of use (ToU) tariff-based electricity cost and system marginal price (SMP), and minimizes the amount of grid power consumption. Power management of nanogrid clusters with P2P power trading is simulated on the distribution test feeder in real-time and proposed GCN-PPO technique reduces the electricity cost of nanogrid clusters by 36.7%.

Datasets with significant proportions of bias present threats for training a trustworthy model on NLU tasks. Despite yielding great progress, current debiasing methods impose excessive reliance on the knowledge of bias attributes. Definition of the attributes, however, is elusive and varies across different datasets. Furthermore, leveraging these attributes at input level to bias mitigation may leave a gap between intrinsic properties and the underlying decision rule. To narrow down this gap and liberate the supervision on bias, we suggest extending bias mitigation into feature space. Therefore, a novel model, Recovering Intended-Feature Subspace with Knowledge-Free (RISK) is developed. Assuming that shortcut features caused by various biases are unintended for prediction, RISK views them as redundant features. When delving into a lower manifold to remove redundancies, RISK reveals that an extremely low-dimensional subspace with intended features can robustly represent the highly biased dataset. Empirical results demonstrate our model can consistently improve model generalization to out-of-distribution set, and achieves a new state-of-the-art performance.  ( 2 min )

Exploration is a fundamental challenge in Deep Reinforcement Learning (DRL) based model-free navigation control since typical exploration techniques for target-driven navigation tasks rely on noise or greedy policies, which are sensitive to the density of rewards. In practice, robots are always deployed in complex cluttered environments, containing dense obstacles and narrow passageways, raising natural spare rewards that are hard to be explored for training. Such a problem becomes even more serious when pre-defined tasks are complex and have rich expressivity. In this paper, we focus on these two aspects and present a deep policy gradient algorithm for a task-guided robot with unknown dynamic systems deployed in a complex cluttered environment. Linear Temporal Logic (LTL) is applied to express a rich robotic specification. To overcome the environmental challenge of exploration during training, we propose a novel path planning-guided reward scheme that is dense over the state space, and crucially, robust to the infeasibility of computed geometric paths due to the black-box dynamics. To facilitate LTL satisfaction, our approach decomposes the LTL mission into sub-tasks that are solved using distributed DRL, where the sub-tasks can be trained in parallel, using Deep Policy Gradient algorithms. Our framework is shown to significantly improve performance (effectiveness, efficiency) and exploration of robots tasked with complex missions in large-scale complex environments. The Video demo can be found on YouTube Channel: https://youtu.be/YQRQ2-yMtIk.

Unsupervised domain adaptation (UDA) has been a vital protocol for migrating information learned from a labeled source domain to facilitate the implementation in an unlabeled heterogeneous target domain. Although UDA is typically jointly trained on data from both domains, accessing the labeled source domain data is often restricted, due to concerns over patient data privacy or intellectual property. To sidestep this, we propose "off-the-shelf (OS)" UDA (OSUDA), aimed at image segmentation, by adapting an OS segmentor trained in a source domain to a target domain, in the absence of source domain data in adaptation. Toward this goal, we aim to develop a novel batch-wise normalization (BN) statistics adaptation framework. In particular, we gradually adapt the domain-specific low-order BN statistics, e.g., mean and variance, through an exponential momentum decay strategy, while explicitly enforcing the consistency of the domain shareable high-order BN statistics, e.g., scaling and shifting factors, via our optimization objective. We also adaptively quantify the channel-wise transferability to gauge the importance of each channel, via both low-order statistics divergence and a scaling factor.~Furthermore, we incorporate unsupervised self-entropy minimization into our framework to boost performance alongside a novel queued, memory-consistent self-training strategy to utilize the reliable pseudo label for stable and efficient unsupervised adaptation. We evaluated our OSUDA-based framework on both cross-modality and cross-subtype brain tumor segmentation and cardiac MR to CT segmentation tasks. Our experimental results showed that our memory consistent OSUDA performs better than existing source-relaxed UDA methods and yields similar performance to UDA methods with source data.

Recently, Graph Neural Networks (GNNs) have significantly advanced the performance of machine learning tasks on graphs. However, this technological breakthrough makes people wonder: how does a GNN make such decisions, and can we trust its prediction with high confidence? When it comes to some critical fields such as biomedicine, where making wrong decisions can have severe consequences, interpreting the inner working mechanisms of GNNs before applying them is crucial. In this paper, we propose a novel model-agnostic model-level explanation method for different GNNs that follow the message passing scheme, GNNInterpreter, to explain the high-level decision-making process of the GNN model. More specifically, with continuous relaxation of graphs and the reparameterization trick, GNNInterpreter learns a probabilistic generative graph distribution which produces the most representative graph for the target prediction in the eye of the GNN model. Compared with the only existing work, GNNInterpreter is more computationally efficient and more flexible in generating explanation graphs with different types of node features and edge features, without introducing another blackbox to explain the GNN and without requiring domain-specific knowledge. Additionally, the experimental studies conducted on four different datasets demonstrate that the explanation graph generated by GNNInterpreter can match the desired graph pattern when the model is ideal and reveal potential model pitfalls if there exist any.

Learning diverse skills is one of the main challenges in robotics. To this end, imitation learning approaches have achieved impressive results. These methods require explicitly labeled datasets or assume consistent skill execution to enable learning and active control of individual behaviors, which limits their applicability. In this work, we propose a cooperative adversarial method for obtaining single versatile policies with controllable skill sets from unlabeled datasets containing diverse state transition patterns by maximizing their discriminability. Moreover, we show that by utilizing unsupervised skill discovery in the generative adversarial imitation learning framework, novel and useful skills emerge with successful task fulfillment. Finally, the obtained versatile policies are tested on an agile quadruped robot called Solo 8 and present faithful replications of diverse skills encoded in the demonstrations.  ( 2 min )

We study a sequential decision problem where the learner faces a sequence of $K$-armed stochastic bandit tasks. An adversary may design the tasks, but the adversary is constrained to choose the optimal arm of each task in a smaller (but unknown) subset of $M$ arms. The task boundaries might be known (the bandit meta-learning setting), or unknown (the non-stationary bandit setting). We design an algorithm based on a reduction to bandit submodular maximization and show that, in the regime of large number of tasks and small number of optimal arms, its regret in both settings is smaller than the simple baseline of $\tilde{O}(\sqrt{KNT})$ that can be obtained by using standard algorithms designed for non-stationary bandit problems. For the bandit meta-learning problem with fixed task length $\tau$, we show that the regret of the algorithm is bounded as $\tilde{O}(NM\sqrt{M \tau}+N^{2/3}M\tau)$. Under additional assumptions on the identifiability of the optimal arms in each task, we show a bandit meta-learning algorithm with an improved $\tilde{O}(N\sqrt{M \tau}+N^{1/2}\sqrt{M K \tau})$ regret.  ( 3 min )

Learning a single static convolutional kernel in each convolutional layer is the common training paradigm of modern Convolutional Neural Networks (CNNs). Instead, recent research in dynamic convolution shows that learning a linear combination of $n$ convolutional kernels weighted with their input-dependent attentions can significantly improve the accuracy of light-weight CNNs, while maintaining efficient inference. However, we observe that existing works endow convolutional kernels with the dynamic property through one dimension (regarding the convolutional kernel number) of the kernel space, but the other three dimensions (regarding the spatial size, the input channel number and the output channel number for each convolutional kernel) are overlooked. Inspired by this, we present Omni-dimensional Dynamic Convolution (ODConv), a more generalized yet elegant dynamic convolution design, to advance this line of research. ODConv leverages a novel multi-dimensional attention mechanism with a parallel strategy to learn complementary attentions for convolutional kernels along all four dimensions of the kernel space at any convolutional layer. As a drop-in replacement of regular convolutions, ODConv can be plugged into many CNN architectures. Extensive experiments on the ImageNet and MS-COCO datasets show that ODConv brings solid accuracy boosts for various prevailing CNN backbones including both light-weight and large ones, e.g., 3.77%~5.71%|1.86%~3.72% absolute top-1 improvements to MobivleNetV2|ResNet family on the ImageNet dataset. Intriguingly, thanks to its improved feature learning ability, ODConv with even one single kernel can compete with or outperform existing dynamic convolution counterparts with multiple kernels, substantially reducing extra parameters. Furthermore, ODConv is also superior to other attention modules for modulating the output features or the convolutional weights.

Graph contrastive learning (GCL) is prevalent to tackle the supervision shortage issue in graph learning tasks. Many recent GCL methods have been proposed with various manually designed augmentation techniques, aiming to implement challenging augmentations on the original graph to yield robust representation. Although many of them achieve remarkable performances, existing GCL methods still struggle to improve model robustness without risking losing task-relevant information because they ignore the fact the augmentation-induced latent factors could be highly entangled with the original graph, thus it is more difficult to discriminate the task-relevant information from irrelevant information. Consequently, the learned representation is either brittle or unilluminating. In light of this, we introduce the Adversarial Cross-View Disentangled Graph Contrastive Learning (ACDGCL), which follows the information bottleneck principle to learn minimal yet sufficient representations from graph data. To be specific, our proposed model elicits the augmentation-invariant and augmentation-dependent factors separately. Except for the conventional contrastive loss which guarantees the consistency and sufficiency of the representations across different contrastive views, we introduce a cross-view reconstruction mechanism to pursue the representation disentanglement. Besides, an adversarial view is added as the third view of contrastive loss to enhance model robustness. We empirically demonstrate that our proposed model outperforms the state-of-the-arts on graph classification task over multiple benchmark datasets.

In this paper, we consider decentralized optimization problems where agents have individual cost functions to minimize subject to subspace constraints that require the minimizers across the network to lie in low-dimensional subspaces. This constrained formulation includes consensus or single-task optimization as special cases, and allows for more general task relatedness models such as multitask smoothness and coupled optimization. In order to cope with communication constraints, we propose and study an adaptive decentralized strategy where the agents employ differential randomized quantizers to compress their estimates before communicating with their neighbors. The analysis shows that, under some general conditions on the quantization noise, and for sufficiently small step-sizes $\mu$, the strategy is stable both in terms of mean-square error and average bit rate: by reducing $\mu$, it is possible to keep the estimation errors small (on the order of $\mu$) without increasing indefinitely the bit rate as $\mu\rightarrow 0$. Simulations illustrate the theoretical findings and the effectiveness of the proposed approach, revealing that decentralized learning is achievable at the expense of only a few bits.  ( 2 min )

With the wide spread of sensors and smart devices in recent years, the data generation speed of the Internet of Things (IoT) systems has increased dramatically. In IoT systems, massive volumes of data must be processed, transformed, and analyzed on a frequent basis to enable various IoT services and functionalities. Machine Learning (ML) approaches have shown their capacity for IoT data analytics. However, applying ML models to IoT data analytics tasks still faces many difficulties and challenges, specifically, effective model selection, design/tuning, and updating, which have brought massive demand for experienced data scientists. Additionally, the dynamic nature of IoT data may introduce concept drift issues, causing model performance degradation. To reduce human efforts, Automated Machine Learning (AutoML) has become a popular field that aims to automatically select, construct, tune, and update machine learning models to achieve the best performance on specified tasks. In this paper, we conduct a review of existing methods in the model selection, tuning, and updating procedures in the area of AutoML in order to identify and summarize the optimal solutions for every step of applying ML algorithms to IoT data analytics. To justify our findings and help industrial users and researchers better implement AutoML approaches, a case study of applying AutoML to IoT anomaly detection problems is conducted in this work. Lastly, we discuss and classify the challenges and research directions for this domain.  ( 3 min )

The COVID-19 pandemic has posed a heavy burden to the healthcare system worldwide and caused huge social disruption and economic loss. Many deep learning models have been proposed to conduct clinical predictive tasks such as mortality prediction for COVID-19 patients in intensive care units using Electronic Health Record (EHR) data. Despite their initial success in certain clinical applications, there is currently a lack of benchmarking results to achieve a fair comparison so that we can select the optimal model for clinical use. Furthermore, there is a discrepancy between the formulation of traditional prediction tasks and real-world clinical practice in intensive care. To fill these gaps, we propose two clinical prediction tasks, Outcome-specific length-of-stay prediction and Early mortality prediction for COVID-19 patients in intensive care units. The two tasks are adapted from the naive length-of-stay and mortality prediction tasks to accommodate the clinical practice for COVID-19 patients. We propose fair, detailed, open-source data-preprocessing pipelines and evaluate 17 state-of-the-art predictive models on two tasks, including 5 machine learning models, 6 basic deep learning models and 6 deep learning predictive models specifically designed for EHR data. We provide benchmarking results using data from two real-world COVID-19 EHR datasets. Both datasets are publicly available without needing any inquiry and one dataset can be accessed on request. We provide fair, reproducible benchmarking results for two tasks. We deploy all experiment results and models on an online platform. We also allow clinicians and researchers to upload their data to the platform and get quick prediction results using our trained models. We hope our efforts can further facilitate deep learning and machine learning research for COVID-19 predictive modeling.  ( 3 min )

Many data mining tasks rely on graphs to model relational structures among individuals (nodes). Since relational data are often sensitive, there is an urgent need to evaluate the privacy risks in graph data. One famous privacy attack against data analysis models is the model inversion attack, which aims to infer sensitive data in the training dataset and leads to great privacy concerns. Despite its success in grid-like domains, directly applying model inversion attacks on non-grid domains such as graph leads to poor attack performance. This is mainly due to the failure to consider the unique properties of graphs. To bridge this gap, we conduct a systematic study on model inversion attacks against Graph Neural Networks (GNNs), one of the state-of-the-art graph analysis tools in this paper. Firstly, in the white-box setting where the attacker has full access to the target GNN model, we present GraphMI to infer the private training graph data. Specifically, in GraphMI, a projected gradient module is proposed to tackle the discreteness of graph edges and preserve the sparsity and smoothness of graph features; a graph auto-encoder module is used to efficiently exploit graph topology, node attributes, and target model parameters for edge inference; a random sampling module can finally sample discrete edges. Furthermore, in the hard-label black-box setting where the attacker can only query the GNN API and receive the classification results, we propose two methods based on gradient estimation and reinforcement learning (RL-GraphMI). Our experimental results show that such defenses are not sufficiently effective and call for more advanced defenses against privacy attacks.  ( 3 min )

The medial temporal lobe (MTL), a brain region containing the hippocampus and nearby areas, is hypothesized to be an experience-construction system in mammals, supporting both recall and imagination of temporally-extended sequences of events. Such capabilities are also core to many recently proposed ``world models" in the field of AI research. Taking inspiration from this connection, we propose a novel variant, the Dual Stream World Model (DSWM), which learns from high-dimensional observations and dissociates them into context and content streams. DSWM can reliably generate imagined trajectories in novel 2D environments after only a single exposure, outperforming a standard world model. DSWM also learns latent representations which bear a strong resemblance to place cells found in the hippocampus. We show that this representation is useful as a reinforcement learning basis function, and that the generative model can be used to aid the policy learning process using Dyna-like updates.  ( 2 min )

Context: The identification of bugs within the reported issues in an issue tracker is crucial for the triage of issues. Machine learning models have shown promising results regarding the performance of automated issue type prediction. However, we have only limited knowledge beyond our assumptions how such models identify bugs. LIME and SHAP are popular technique to explain the predictions of classifiers. Objective: We want to understand if machine learning models provide explanations for the classification that are reasonable to us as humans and align with our assumptions of what the models should learn. We also want to know if the prediction quality is correlated with the quality of explanations. Method: We conduct a study where we rate LIME and SHAP explanations based on their quality of explaining the outcome of an issue type prediction model. For this, we rate the quality of the explanations themselves, i.e., if they align with our expectations and if they help us to understand the underlying machine learning model.  ( 2 min )

Smartwatches or fitness trackers have garnered a lot of popularity as potential health tracking devices due to their affordable and longitudinal monitoring capabilities. To further widen their health tracking capabilities, in recent years researchers have started to look into the possibility of Atrial Fibrillation (AF) detection in real-time leveraging photoplethysmography (PPG) data, an inexpensive sensor widely available in almost all smartwatches. A significant challenge in AF detection from PPG signals comes from the inherent noise in the smartwatch PPG signals. In this paper, we propose a novel deep learning based approach, BayesBeat that leverages the power of Bayesian deep learning to accurately infer AF risks from noisy PPG signals, and at the same time provides an uncertainty estimate of the prediction. Extensive experiments on two publicly available dataset reveal that our proposed method BayesBeat outperforms the existing state-of-the-art methods. Moreover, BayesBeat is substantially more efficient having 40-200X fewer parameters than state-of-the-art baseline approaches making it suitable for deployment in resource constrained wearable devices.  ( 3 min )

While graph neural networks (GNNs) have been successful for node classification tasks and link prediction tasks in graph, learning graph-level representations still remains a challenge. For the graph-level representation, it is important to learn both representation of neighboring nodes, i.e., aggregation, and graph structural information. A number of graph pooling methods have been developed for this goal. However, most of the existing pooling methods utilize k-hop neighborhood without considering explicit structural information in a graph. In this paper, we propose Structure Prototype Guided Pooling (SPGP) that utilizes prior graph structures to overcome the limitation. SPGP formulates graph structures as learnable prototype vectors and computes the affinity between nodes and prototype vectors. This leads to a novel node scoring scheme that prioritizes informative nodes while encapsulating the useful structures of the graph. Our experimental results show that SPGP outperforms state-of-the-art graph pooling methods on graph classification benchmark datasets in both accuracy and scalability.  ( 2 min )

Feature transformation aims to extract a good representation (feature) space by mathematically transforming existing features. It is crucial to address the curse of dimensionality, enhance model generalization, overcome data sparsity, and expand the availability of classic models. Current research focuses on domain knowledge-based feature engineering or learning latent representations; nevertheless, these methods are not entirely automated and cannot produce a traceable and optimal representation space. When rebuilding a feature space for a machine learning task, can these limitations be addressed concurrently? In this extension study, we present a self-optimizing framework for feature transformation. To achieve a better performance, we improved the preliminary work by (1) obtaining an advanced state representation for enabling reinforced agents to comprehend the current feature set better; and (2) resolving Q-value overestimation in reinforced agents for learning unbiased and effective policies. Finally, to make experiments more convincing than the preliminary work, we conclude by adding the outlier detection task with five datasets, evaluating various state representation approaches, and comparing different training strategies. Extensive experiments and case studies show that our work is more effective and superior.  ( 2 min )

Log analysis is one of the main techniques engineers use to troubleshoot faults of large-scale software systems. During the past decades, many log analysis approaches have been proposed to detect system anomalies reflected by logs. They usually take log event counts or sequential log events as inputs and utilize machine learning algorithms including deep learning models to detect system anomalies. These anomalies are often identified as violations of quantitative relational patterns or sequential patterns of log events in log sequences. However, existing methods fail to leverage the spatial structural relationships among log events, resulting in potential false alarms and unstable performance. In this study, we propose a novel graph-based log anomaly detection method, LogGD, to effectively address the issue by transforming log sequences into graphs. We exploit the powerful capability of Graph Transformer Neural Network, which combines graph structure and node semantics for log-based anomaly detection. We evaluate the proposed method on four widely-used public log datasets. Experimental results show that LogGD can outperform state-of-the-art quantitative-based and sequence-based methods and achieve stable performance under different window size settings. The results confirm that LogGD is effective in log-based anomaly detection.

Community detection and orthogonal group synchronization are both fundamental problems with a variety of important applications in science and engineering. In this work, we consider the joint problem of community detection and orthogonal group synchronization which aims to recover the communities and perform synchronization simultaneously. To this end, we propose a simple algorithm that consists of a spectral decomposition step followed by a blockwise column pivoted QR factorization (CPQR). The proposed algorithm is efficient and scales linearly with the number of edges in the graph. We also leverage the recently developed `leave-one-out' technique to establish a near-optimal guarantee for exact recovery of the cluster memberships and stable recovery of the orthogonal transforms. Numerical experiments demonstrate the efficiency and efficacy of our algorithm and confirm our theoretical characterization of it.

Efficient custom pooling techniques that can aggressively trim the dimensions of a feature map and thereby reduce inference compute and memory footprint for resource-constrained computer vision applications have recently gained significant traction. However, prior pooling works extract only the local context of the activation maps, limiting their effectiveness. In contrast, we propose a novel non-local self-attentive pooling method that can be used as a drop-in replacement to the standard pooling layers, such as max/average pooling or strided convolution. The proposed self-attention module uses patch embedding, multi-head self-attention, and spatial-channel restoration, followed by sigmoid activation and exponential soft-max. This self-attention mechanism efficiently aggregates dependencies between non-local activation patches during down-sampling. Extensive experiments on standard object classification and detection tasks with various convolutional neural network (CNN) architectures demonstrate the superiority of our proposed mechanism over the state-of-the-art (SOTA) pooling techniques. In particular, we surpass the test accuracy of existing pooling techniques on different variants of MobileNet-V2 on ImageNet by an average of 1.2%. With the aggressive down-sampling of the activation maps in the initial layers (providing up to 22x reduction in memory consumption), our approach achieves 1.43% higher test accuracy compared to SOTA techniques with iso-memory footprints. This enables the deployment of our models in memory-constrained devices, such as micro-controllers (without losing significant accuracy), because the initial activation maps consume a significant amount of on-chip memory for high-resolution images required for complex vision tasks. Our proposed pooling method also leverages the idea of channel pruning to further reduce memory footprints.  ( 3 min )

Continual learning and few-shot learning are important frontiers in the quest to improve Machine Learning. There is a growing body of work in each frontier, but very little combining the two. Recently however, Antoniou et al. arXiv:2004.11967 introduced a Continual Few-shot Learning framework, CFSL, that combines both. In this study, we extended CFSL to make it more comparable to standard continual learning experiments, where usually a much larger number of classes are presented. We also introduced an `instance test' to classify very similar specific instances - a capability of animal cognition that is usually neglected in ML. We selected representative baseline models from the original CFSL work and compared to a model with Hippocampal-inspired replay, as the Hippocampus is considered to be vital to this type of learning in animals. As expected, learning more classes is more difficult than the original CFSL experiments, and interestingly, the way in which they are presented makes a difference to performance. Accuracy in the instance test is comparable to the classification tasks. The use of replay for consolidation improves performance substantially for both types of tasks, particularly the instance test.

Removing background noise from speech audio has been the subject of considerable effort, especially in recent years due to the rise of virtual communication and amateur recordings. Yet background noise is not the only unpleasant disturbance that can prevent intelligibility: reverb, clipping, codec artifacts, problematic equalization, limited bandwidth, or inconsistent loudness are equally disturbing and ubiquitous. In this work, we propose to consider the task of speech enhancement as a holistic endeavor, and present a universal speech enhancement system that tackles 55 different distortions at the same time. Our approach consists of a generative model that employs score-based diffusion, together with a multi-resolution conditioning network that performs enhancement with mixture density networks. We show that this approach significantly outperforms the state of the art in a subjective test performed by expert listeners. We also show that it achieves competitive objective scores with just 4-8 diffusion steps, despite not considering any particular strategy for fast sampling. We hope that both our methodology and technical contributions encourage researchers and practitioners to adopt a universal approach to speech enhancement, possibly framing it as a generative task.

Distributed deep learning frameworks such as split learning provide great benefits with regards to the computational cost of training deep neural networks and the privacy-aware utilization of the collective data of a group of data-holders. Split learning, in particular, achieves this goal by dividing a neural network between a client and a server so that the client computes the initial set of layers, and the server computes the rest. However, this method introduces a unique attack vector for a malicious server attempting to steal the client's private data: the server can direct the client model towards learning any task of its choice, e.g. towards outputting easily invertible values. With a concrete example already proposed (Pasquini et al., CCS '21), such training-hijacking attacks present a significant risk for the data privacy of split learning clients. In this paper, we propose SplitGuard, a method by which a split learning client can detect whether it is being targeted by a training-hijacking attack or not. We experimentally evaluate our method's effectiveness, compare it with potential alternatives, and discuss in detail various points related to its use. We conclude that SplitGuard can effectively detect training-hijacking attacks while minimizing the amount of information recovered by the adversaries.

Data poisoning considers an adversary that distorts the training set of machine learning algorithms for malicious purposes. In this work, we bring to light one conjecture regarding the fundamentals of data poisoning, which we call the Lethal Dose Conjecture. The conjecture states: If $n$ clean training samples are needed for accurate predictions, then in a size-$N$ training set, only $\Theta(N/n)$ poisoned samples can be tolerated while ensuring accuracy. Theoretically, we verify this conjecture in multiple cases. We also offer a more general perspective of this conjecture through distribution discrimination. Deep Partition Aggregation (DPA) and its extension, Finite Aggregation (FA) are recent approaches for provable defenses against data poisoning, where they predict through the majority vote of many base models trained from different subsets of training set using a given learner. The conjecture implies that both DPA and FA are (asymptotically) optimal -- if we have the most data-efficient learner, they can turn it into one of the most robust defenses against data poisoning. This outlines a practical approach to developing stronger defenses against poisoning via finding data-efficient learners. Empirically, as a proof of concept, we show that by simply using different data augmentations for base learners, we can respectively double and triple the certified robustness of DPA on CIFAR-10 and GTSRB without sacrificing accuracy.

To enable learning on edge devices with fast convergence and low memory, we present a novel backpropagation-free optimization algorithm dubbed Target Projection Stochastic Gradient Descent (tpSGD). tpSGD generalizes direct random target projection to work with arbitrary loss functions and extends target projection for training recurrent neural networks (RNNs) in addition to feedforward networks. tpSGD uses layer-wise stochastic gradient descent (SGD) and local targets generated via random projections of the labels to train the network layer-by-layer with only forward passes. tpSGD doesn't require retaining gradients during optimization, greatly reducing memory allocation compared to SGD backpropagation (BP) methods that require multiple instances of the entire neural network weights, input/output, and intermediate results. Our method performs comparably to BP gradient-descent within 5% accuracy on relatively shallow networks of fully connected layers, convolutional layers, and recurrent layers. tpSGD also outperforms other state-of-the-art gradient-free algorithms in shallow models consisting of multi-layer perceptrons, convolutional neural networks (CNNs), and RNNs with competitive accuracy and less memory and time. We evaluate the performance of tpSGD in training deep neural networks (e.g. VGG) and extend the approach to multi-layer RNNs. These experiments highlight new research directions related to optimized layer-based adaptor training for domain-shift using tpSGD at the edge.

The combinatorial problem of learning directed acyclic graphs (DAGs) from data was recently framed as a purely continuous optimization problem by leveraging a differentiable acyclicity characterization of DAGs based on the trace of a matrix exponential function. Existing acyclicity characterizations are based on the idea that powers of an adjacency matrix contain information about walks and cycles. In this work, we propose a $\textit{fundamentally different}$ acyclicity characterization based on the log-determinant (log-det) function, which leverages the nilpotency property of DAGs. To deal with the inherent asymmetries of a DAG, we relate the domain of our log-det characterization to the set of $\textit{M-matrices}$, which is a key difference to the classical log-det function defined over the cone of positive definite matrices. Similar to acyclicity functions previously proposed, our characterization is also exact and differentiable. However, when compared to existing characterizations, our log-det function: (1) Is better at detecting large cycles; (2) Has better-behaved gradients; and (3) Its runtime is in practice about an order of magnitude faster. From the optimization side, we drop the typically used augmented Lagrangian scheme, and propose DAGMA ($\textit{Directed Acyclic Graphs via M-matrices for Acyclicity}$), a method that resembles the central path for barrier methods. Each point in the central path of DAGMA is a solution to an unconstrained problem regularized by our log-det function, then we show that at the limit of the central path the solution is guaranteed to be a DAG. Finally, we provide extensive experiments for $\textit{linear}$ and $\textit{nonlinear}$ SEMs, and show that our approach can reach large speed-ups and smaller structural Hamming distances against state-of-the-art methods.

Boosted trees is a dominant ML model, exhibiting high accuracy. However, boosted trees are hardly intelligible, and this is a problem whenever they are used in safety-critical applications. Indeed, in such a context, rigorous explanations of the predictions made are expected. Recent work have shown how subset-minimal abductive explanations can be derived for boosted trees, using automated reasoning techniques. However, the generation of such well-founded explanations is intractable in the general case. To improve the scalability of their generation, we introduce the notion of tree-specific explanation for a boosted tree. We show that tree-specific explanations are abductive explanations that can be computed in polynomial time. We also explain how to derive a subset-minimal abductive explanation from a tree-specific explanation. Experiments on various datasets show the computational benefits of leveraging tree-specific explanations for deriving subset-minimal abductive explanations.

The utility of machine learning in evaluating the creditworthiness of loan applicants has been proofed since decades ago. However, automatic decisions may lead to different treatments over groups or individuals, potentially causing discrimination. This paper benchmarks 12 top bias mitigation methods discussing their performance based on 5 different fairness metrics, accuracy achieved and potential profits for the financial institutions. Our findings show the difficulties in achieving fairness while preserving accuracy and profits. Additionally, it highlights some of the best and worst performers and helps bridging the gap between experimental machine learning and its industrial application.  ( 2 min )

Supervised learning algorithms generally assume the availability of enough memory to store their data model during the training and test phases. However, in the Internet of Things, this assumption is unrealistic when data comes in the form of infinite data streams, or when learning algorithms are deployed on devices with reduced amounts of memory. In this paper, we adapt the online Mondrian forest classification algorithm to work with memory constraints on data streams. In particular, we design five out-of-memory strategies to update Mondrian trees with new data points when the memory limit is reached. Moreover, we design trimming mechanisms to make Mondrian trees more robust to concept drifts under memory constraints. We evaluate our algorithms on a variety of real and simulated datasets, and we conclude with recommendations on their use in different situations: the Extend Node strategy appears as the best out-of-memory strategy in all configurations, whereas different trimming mechanisms should be adopted depending on whether a concept drift is expected. All our methods are implemented in the OrpailleCC open-source library and are ready to be used on embedded systems and connected objects.

A trustworthy reinforcement learning algorithm should be competent in solving challenging real-world problems, including {robustly} handling uncertainties, satisfying {safety} constraints to avoid catastrophic failures, and {generalizing} to unseen scenarios during deployments. This study aims to overview these main perspectives of trustworthy reinforcement learning considering its intrinsic vulnerabilities on robustness, safety, and generalizability. In particular, we give rigorous formulations, categorize corresponding methodologies, and discuss benchmarks for each perspective. Moreover, we provide an outlook section to spur promising future directions with a brief discussion on extrinsic vulnerabilities considering human feedback. We hope this survey could bring together separate threads of studies together in a unified framework and promote the trustworthiness of reinforcement learning.

Mosquito-borne diseases (MBDs), such as dengue virus, chikungunya virus, and West Nile virus, cause over one million deaths globally every year. Because many such diseases are spread by the Aedes and Culex mosquitoes, tracking these larvae becomes critical in mitigating the spread of MBDs. Even as citizen science grows and obtains larger mosquito image datasets, the manual annotation of mosquito images becomes ever more time-consuming and inefficient. Previous research has used computer vision to identify mosquito species, and the Convolutional Neural Network (CNN) has become the de-facto for image classification. However, these models typically require substantial computational resources. This research introduces the application of the Vision Transformer (ViT) in a comparative study to improve image classification on Aedes and Culex larvae. Two ViT models, ViT-Base and CvT-13, and two CNN models, ResNet-18 and ConvNeXT, were trained on mosquito larvae image data and compared to determine the most effective model to distinguish mosquito larvae as Aedes or Culex. Testing revealed that ConvNeXT obtained the greatest values across all classification metrics, demonstrating its viability for mosquito larvae classification. Based on these results, future research includes creating a model specifically designed for mosquito larvae classification by combining elements of CNN and transformer architecture.

Since the development of writing 5000 years ago, human-generated data gets produced at an ever-increasing pace. Classical archival methods aimed at easing information retrieval. Nowadays, archiving is not enough anymore. The amount of data that gets generated daily is beyond human comprehension, and appeals for new information retrieval strategies. Instead of referencing every single data piece as in traditional archival techniques, a more relevant approach consists in understanding the overall ideas conveyed in data flows. To spot such general tendencies, a precise comprehension of the underlying data generation mechanisms is required. In the rich literature tackling this problem, the question of information interaction remains nearly unexplored. First, we investigate the frequency of such interactions. Building on recent advances made in Stochastic Block Modelling, we explore the role of interactions in several social networks. We find that interactions are rare in these datasets. Then, we wonder how interactions evolve over time. Earlier data pieces should not have an everlasting influence on ulterior data generation mechanisms. We model this using dynamic network inference advances. We conclude that interactions are brief. Finally, we design a framework that jointly models rare and brief interactions based on Dirichlet-Hawkes Processes. We argue that this new class of models fits brief and sparse interaction modelling. We conduct a large-scale application on Reddit and find that interactions play a minor role in this dataset. From a broader perspective, our work results in a collection of highly flexible models and in a rethinking of core concepts of machine learning. Consequently, we open a range of novel perspectives both in terms of real-world applications and in terms of technical contributions to machine learning.

We present a meta-method for initializing (seeding) the $k$-means clustering algorithm called PNN-smoothing. It consists in splitting a given dataset into $J$ random subsets, clustering each of them individually, and merging the resulting clusterings with the pairwise-nearest-neighbor (PNN) method. It is a meta-method in the sense that when clustering the individual subsets any seeding algorithm can be used. If the computational complexity of that seeding algorithm is linear in the size of the data $N$ and the number of clusters $k$, PNN-smoothing is also almost linear with an appropriate choice of $J$, and quite competitive in practice. We show empirically, using several existing seeding methods and testing on several synthetic and real datasets, that this procedure results in systematically better costs. Our implementation is publicly available at https://github.com/carlobaldassi/KMeansPNNSmoothing.jl.

We investigate the graph-based convolutional neural network approach for predicting and ranking gas adsorption properties of crystalline Metal-Organic Framework (MOF) adsorbents for application in post-combustion capture of $\textrm{CO}_2$. Our model is based solely on standard structural input files containing atomistic descriptions of the adsorbent material candidates. We construct novel methodological extensions to match the prediction accuracy of classical machine learning models that were built with hundreds of features at much higher computational cost. Our approach can be more broadly applied to optimize gas capture processes at industrial scale.

Machine Learning (ML) algorithms based on gradient boosted decision trees (GBDT) are still favored on many tabular data tasks across various mission critical applications, from healthcare to finance. However, GBDT algorithms are not free of the risk of bias and discriminatory decision-making. Despite GBDT's popularity and the rapid pace of research in fair ML, existing in-processing fair ML methods are either inapplicable to GBDT, incur in significant train time overhead, or are inadequate for problems with high class imbalance. We present FairGBM, a learning framework for training GBDT under fairness constraints with little to no impact on predictive performance when compared to unconstrained LightGBM. Since common fairness metrics are non-differentiable, we employ a ``proxy-Lagrangian'' formulation using smooth convex error rate proxies to enable gradient-based optimization. Additionally, our open-source implementation shows an order of magnitude speedup in training time when compared with related work, a pivotal aspect to foster the widespread adoption of FairGBM by real-world practitioners.

We consider the problem of detecting latent community information of mixed membership weighted network in which nodes have mixed memberships and edges connecting between nodes can be finite real numbers. We propose a general mixed membership distribution-free model for this problem. The model has no distribution constraints of edges but only the expected values, and can be viewed as generalizations of some previous models. We use an efficient spectral algorithm to estimate community memberships under the model. We also derive the convergence rate of the proposed algorithm under the model using spectral analysis. We demonstrate the advantages of mixed membership distribution-free model and the algorithm with applications to a small scale of simulated networks when edges follow different distributions. We have also applied the algorithm to five real world weighted network data sets with encouraging results.

Inferring the timing and amplitude of perturbations in epidemiological systems from their stochastically spread low-resolution outcomes is as relevant as challenging. It is a requirement for current approaches to overcome the need to know the details of the perturbations to proceed with the analyses. However, the general problem of connecting epidemiological curves with the underlying incidence lacks the highly effective methodology present in other inverse problems, such as super-resolution and dehazing from computer vision. Here, we develop an unsupervised physics-informed convolutional neural network approach in reverse to connect death records with incidence that allows the identification of regime changes at single-day resolution. Applied to COVID-19 data with proper regularization and model-selection criteria, the approach can identify the implementation and removal of lockdowns and other nonpharmaceutical interventions with 0.93-day accuracy over the time span of a year.

In this work, we propose a permutation invariant language model, SymphonyNet, as a solution for symbolic symphony music generation. We propose a novel Multi-track Multi-instrument Repeatable (MMR) representation for symphonic music and model the music sequence using a Transformer-based auto-regressive language model with specific 3-D positional embedding. To overcome length overflow when modeling extra-long symphony tokens, we also propose a modified Byte Pair Encoding algorithm (Music BPE) for music tokens and introduce a novel linear transformer decoder architecture as a backbone. Meanwhile, we train the decoder to learn automatic orchestration as a joint task by masking instrument information from the input. We also introduce a large-scale symbolic symphony dataset for the advance of symphony generation research. Empirical results show that the proposed approach can generate coherent, novel, complex and harmonious symphony as a pioneer solution for multi-track multi-instrument symbolic music generation.

Humans learn continually throughout their lifespan by accumulating diverse knowledge and fine-tuning it for future tasks. When presented with a similar goal, neural networks suffer from catastrophic forgetting if data distributions across sequential tasks are not stationary over the course of learning. An effective approach to address such continual learning (CL) problems is to use hypernetworks which generate task dependent weights for a target network. However, the continual learning performance of existing hypernetwork based approaches are affected by the assumption of independence of the weights across the layers in order to maintain parameter efficiency. To address this limitation, we propose a novel approach that uses a dependency preserving hypernetwork to generate weights for the target network while also maintaining the parameter efficiency. We propose to use recurrent neural network (RNN) based hypernetwork that can generate layer weights efficiently while allowing for dependencies across them. In addition, we propose novel regularisation and network growth techniques for the RNN based hypernetwork to further improve the continual learning performance. To demonstrate the effectiveness of the proposed methods, we conducted experiments on several image classification continual learning tasks and settings. We found that the proposed methods based on the RNN hypernetworks outperformed the baselines in all these CL settings and tasks.  ( 3 min )

The impressive performances of deep learning architectures is associated to massive increase of models complexity. Millions of parameters need be tuned, with training and inference time scaling accordingly. But is massive fine-tuning necessary? In this paper, focusing on image classification, we consider a simple transfer learning approach exploiting pretrained convolutional features as input for a fast kernel method. We refer to this approach as top-tuning, since only the kernel classifier is trained. By performing more than 2500 training processes we show that this top-tuning approach provides comparable accuracy w.r.t. fine-tuning, with a training time that is between one and two orders of magnitude smaller. These results suggest that top-tuning provides a useful alternative to fine-tuning in small/medium datasets, especially when training efficiency is crucial.  ( 2 min )

Modern biomedical studies often collect multi-view data, that is, multiple types of data measured on the same set of objects. A popular model in high-dimensional multi-view data analysis is to decompose each view's data matrix into a low-rank common-source matrix generated by latent factors common across all data views, a low-rank distinctive-source matrix corresponding to each view, and an additive noise matrix. We propose a novel decomposition method for this model, called decomposition-based generalized canonical correlation analysis (D-GCCA). The D-GCCA rigorously defines the decomposition on the L2 space of random variables in contrast to the Euclidean dot product space used by most existing methods, thereby being able to provide the estimation consistency for the low-rank matrix recovery. Moreover, to well calibrate common latent factors, we impose a desirable orthogonality constraint on distinctive latent factors. Existing methods, however, inadequately consider such orthogonality and may thus suffer from substantial loss of undetected common-source variation. Our D-GCCA takes one step further than generalized canonical correlation analysis by separating common and distinctive components among canonical variables, while enjoying an appealing interpretation from the perspective of principal component analysis. Furthermore, we propose to use the variable-level proportion of signal variance explained by common or distinctive latent factors for selecting the variables most influenced. Consistent estimators of our D-GCCA method are established with good finite-sample numerical performance, and have closed-form expressions leading to efficient computation especially for large-scale data. The superiority of D-GCCA over state-of-the-art methods is also corroborated in simulations and real-world data examples.  ( 3 min )

Multivariate time series(MTS) is a universal data type related to many practical applications. However, MTS suffers from missing data problems, which leads to degradation or even collapse of the downstream tasks, such as prediction and classification. The concurrent missing data handling procedures could inevitably arouse the biased estimation and redundancy-training problem when encountering multiple downstream tasks. This paper presents a universally applicable MTS pre-train model, DBT-DMAE, to conquer the abovementioned obstacle. First, a missing representation module is designed by introducing dynamic positional embedding and random masking processing to characterize the missing symptom. Second, we proposed an auto-encoder structure to obtain the generalized MTS encoded representation utilizing an ameliorated TCN structure called dynamic-bidirectional-TCN as the basic unit, which integrates the dynamic kernel and time-fliping trick to draw temporal features effectively. Finally, the overall feed-in and loss strategy is established to ensure the adequate training of the whole model. Comparative experiment results manifest that the DBT-DMAE outperforms the other state-of-the-art methods in six real-world datasets and two different downstream tasks. Moreover, ablation and interpretability experiments are delivered to verify the validity of DBT-DMAE's substructures.  ( 2 min )

Out-of-distribution (OOD) detection is the key to deploying models safely in the open world. For OOD detection, collecting sufficient in-distribution (ID) labeled data is usually more time-consuming and costly than unlabeled data. When ID labeled data is limited, the previous OOD detection methods are no longer superior due to their high dependence on the amount of ID labeled data. Based on limited ID labeled data and sufficient unlabeled data, we define a new setting called Weakly-Supervised Out-of-Distribution Detection (WSOOD). To solve the new problem, we propose an effective method called Topological Structure Learning (TSL). Firstly, TSL uses a contrastive learning method to build the initial topological structure space for ID and OOD data. Secondly, TSL mines effective topological connections in the initial topological space. Finally, based on limited ID labeled data and mined topological connections, TSL reconstructs the topological structure in a new topological space to increase the separability of ID and OOD instances. Extensive studies on several representative datasets show that TSL remarkably outperforms the state-of-the-art, verifying the validity and robustness of our method in the new setting of WSOOD.  ( 2 min )

Reject inference comprises techniques to infer the possible repayment behavior of rejected cases. In this paper, we model credit in a brand new view by capturing the sequential pattern of interactions among multiple stages of loan business to make better use of the underlying causal relationship. Specifically, we first define 3 stages with sequential dependence throughout the loan process including credit granting(AR), withdrawal application(WS) and repayment commitment(GB) and integrate them into a multi-task architecture. Inside stages, an intra-stage multi-task classification is built to meet different business goals. Then we design an Information Corridor to express sequential dependence, leveraging the interaction information between customer and platform from former stages via a hierarchical attention module controlling the content and size of the information channel. In addition, semi-supervised loss is introduced to deal with the unobserved instances. The proposed multi-stage interaction sequence(MSIS) method is simple yet effective and experimental results on a real data set from a top loan platform in China show the ability to remedy the population bias and improve model generalization ability.  ( 2 min )

Bayesian Neural Networks with Latent Variables (BNN+LVs) capture predictive uncertainty by explicitly modeling model uncertainty (via priors on network weights) and environmental stochasticity (via a latent input noise variable). In this work, we first show that BNN+LV suffers from a serious form of non-identifiability: explanatory power can be transferred between the model parameters and latent variables while fitting the data equally well. We demonstrate that as a result, in the limit of infinite data, the posterior mode over the network weights and latent variables is asymptotically biased away from the ground-truth. Due to this asymptotic bias, traditional inference methods may in practice yield parameters that generalize poorly and misestimate uncertainty. Next, we develop a novel inference procedure that explicitly mitigates the effects of likelihood non-identifiability during training and yields high-quality predictions as well as uncertainty estimates. We demonstrate that our inference method improves upon benchmark methods across a range of synthetic and real data-sets.

Most models of information diffusion online rely on the assumption that pieces of information spread independently from each other. However, several works pointed out the necessity of investigating the role of interactions in real-world processes, and highlighted possible difficulties in doing so: interactions are sparse and brief. As an answer, recent advances developed models to account for interactions in underlying publication dynamics. In this article, we propose to extend and apply one such model to determine whether interactions between news headlines on Reddit play a significant role in their underlying publication mechanisms. After conducting an in-depth case study on 100,000 news headline from 2019, we retrieve state-of-the-art conclusions about interactions and conclude that they play a minor role in this dataset.

The Gaussian kernel and its traditional normalizations (e.g., row-stochastic) are popular approaches for assessing similarities between data points, commonly used for manifold learning and clustering, as well as supervised and semi-supervised learning on graphs. In many practical situations, the data can be corrupted by noise that prohibits traditional affinity matrices from correctly assessing similarities, especially if the noise magnitudes vary considerably across the data, e.g., under heteroskedasticity or outliers. An alternative approach that provides a more stable behavior under noise is the doubly stochastic normalization of the Gaussian kernel. In this work, we investigate this normalization in a setting where points are sampled from an unknown density on a low-dimensional manifold embedded in high-dimensional space and corrupted by possibly strong, non-identically distributed, sub-Gaussian noise. We establish the pointwise concentration of the doubly stochastic affinity matrix and its scaling factors around certain population forms. We then utilize these results to develop several tools for robust inference. First, we derive a robust density estimator that can substantially outperform the standard kernel density estimator under high-dimensional noise. Second, we provide estimators for the pointwise noise magnitudes, the pointwise signal magnitudes, and the pairwise Euclidean distances between clean data points. Lastly, we derive robust graph Laplacian normalizations that approximate popular manifold Laplacians, including the Laplace Beltrami operator, showing that the local geometry of the manifold can be recovered under high-dimensional noise. We exemplify our results in simulations and on real single-cell RNA-sequencing data. In the latter, we show that our proposed normalizations are robust to technical variability associated with different cell types.

The cancer prognosis on gigapixel Whole-Slide Images (WSIs) has always been a challenging task. To further enhance WSI visual representations, existing methods have explored image pyramids, instead of single-resolution images, in WSIs. In spite of this, they still face two major problems: high computational cost and the unnoticed semantical gap in multi-resolution feature fusion. To tackle these problems, this paper proposes to efficiently exploit WSI pyramids from a new perspective, the dual-stream network with cross-attention (DSCA). Our key idea is to utilize two sub-streams to process the WSI patches with two resolutions, where a square pooling is devised in a high-resolution stream to significantly reduce computational costs, and a cross-attention-based method is proposed to properly handle the fusion of dual-stream features. We validate our DSCA on three publicly-available datasets with a total number of 3,101 WSIs from 1,911 patients. Our experiments and ablation studies verify that (i) the proposed DSCA could outperform existing state-of-the-art methods in cancer prognosis, by an average C-Index improvement of around 4.6%; (ii) our DSCA network is more efficient in computation -- it has more learnable parameters (6.31M vs. 860.18K) but less computational costs (2.51G vs. 4.94G), compared to a typical existing multi-resolution network. (iii) the key components of DSCA, dual-stream and cross-attention, indeed contribute to our model's performance, gaining an average C-Index rise of around 2.0% while maintaining a relatively-small computational load. Our DSCA could serve as an alternative and effective tool for WSI-based cancer prognosis.

The quality of generalized linear models (GLMs), frequently used by insurance companies, depends on the choice of interacting variables. The search for interactions is time-consuming, especially for data sets with a large number of variables, depends much on expert judgement of actuaries, and often relies on visual performance indicators. Therefore, we present an approach to automating the process of finding interactions that should be added to GLMs to improve their predictive power. Our approach relies on neural networks and a model-specific interaction detection method, which is computationally faster than the traditionally used methods like Friedman H-Statistic or SHAP values. In numerical studies, we provide the results of our approach on different data sets: open-source data, artificial data, and proprietary data.

We introduce a constrained optimization method for policy gradient reinforcement learning, which uses a virtual trust region to regulate each policy update. In addition to using the proximity of one single old policy as the normal trust region, we propose forming a second trust region through another virtual policy representing a wide range of past policies. We then enforce the new policy to stay closer to the virtual policy, which is beneficial if the old policy performs poorly. More importantly, we propose a mechanism to automatically build the virtual policy from a memory of past policies, providing a new capability for dynamically learning appropriate virtual trust regions during the optimization process. Our proposed method, dubbed Memory-Constrained Policy Optimization (MCPO), is examined in diverse environments, including robotic locomotion control, navigation with sparse rewards and Atari games, consistently demonstrating competitive performance against recent on-policy constrained policy gradient methods.  ( 2 min )

Randomized smoothing is considered to be the state-of-the-art provable defense against adversarial perturbations. However, it heavily exploits the fact that classifiers map input objects to class probabilities and do not focus on the ones that learn a metric space in which classification is performed by computing distances to embeddings of classes prototypes. In this work, we extend randomized smoothing to few-shot learning models that map inputs to normalized embeddings. We provide analysis of Lipschitz continuity of such models and derive robustness certificate against $\ell_2$-bounded perturbations that may be useful in few-shot learning scenarios. Our theoretical results are confirmed by experiments on different datasets.

Lying on the heart of intelligent decision-making systems, how policy is represented and optimized is a fundamental problem. The root challenge in this problem is the large scale and the high complexity of policy space, which exacerbates the difficulty of policy learning especially in real-world scenarios. Towards a desirable surrogate policy space, recently policy representation in a low-dimensional latent space has shown its potential in improving both the evaluation and optimization of policy. The key question involved in these studies is by what criterion we should abstract the policy space for desired compression and generalization. However, both the theory on policy abstraction and the methodology on policy representation learning are less studied in the literature. In this work, we make very first efforts to fill up the vacancy. First, we propose a unified policy abstraction theory, containing three types of policy abstraction associated to policy features at different levels. Then, we generalize them to three policy metrics that quantify the distance (i.e., similarity) of policies, for more convenient use in learning policy representation. Further, we propose a policy representation learning approach based on deep metric learning. For the empirical study, we investigate the efficacy of the proposed policy metrics and representations, in characterizing policy difference and conveying policy generalization respectively. Our experiments are conducted in both policy optimization and evaluation problems, containing trust-region policy optimization (TRPO), diversity-guided evolution strategy (DGES) and off-policy evaluation (OPE). Somewhat naturally, the experimental results indicate that there is no a universally optimal abstraction for all downstream learning problems; while the influence-irrelevance policy abstraction can be a generally preferred choice.  ( 3 min )

Context: Modelling satellite galaxy abundance $N_s$ in Galaxy Clusters (GCs) is a key element in modelling the Halo Occupation Distribution (HOD), which itself is a powerful tool to connect observational studies with numerical simulations. Aims: To study the impact of cosmological parameters on satellite abundance both in cosmological simulations and in mock observations. Methods: We build an emulator (HODEmu, \url{https://github.com/aragagnin/HODEmu/}) of satellite abundance based on cosmological parameters $\Omega_m, \Omega_b, \sigma_8, h_0$ and redshift $z.$ We train our emulator using \magneticum hydrodynamic simulations that span 15 different cosmologies, each over $4$ redshift slices between $0<z<0.5,$ and for each setup we fit normalisation $A$, log-slope $\beta$ and Gaussian fractional-scatter $\sigma$ of the $N_s-M$ relation. The emulator is based on multi-variate output Gaussian Process Regression (GPR). Results: We find that $A$ and $\beta$ depend on cosmological parameters, even if weakly, especially on $\Omega_m,$ $\Omega_b.$ This dependency can explain some discrepancies found in literature between satellite HOD of different cosmological simulations (Magneticum, Illustris, BAHAMAS). We also show that satellite abundance cosmology dependency differs between full-physics (FP) simulations, dark-matter only (DMO), and non-radiative simulations. Conclusions: This work provides a preliminary calibration of the cosmological dependency of the satellite abundance of high mass halos, and we showed that modelling HOD with cosmological parameters is necessary to interpret satellite abundance, and we showed the importance of using FP simulations in modelling this dependency.

In this paper we study estimating Generalized Linear Models (GLMs) in the case where the agents (individuals) are strategic or self-interested and they concern about their privacy when reporting data. Compared with the classical setting, here we aim to design mechanisms that can both incentivize most agents to truthfully report their data and preserve the privacy of individuals' reports, while their outputs should also close to the underlying parameter. In the first part of the paper, we consider the case where the covariates are sub-Gaussian and the responses are heavy-tailed where they only have the finite fourth moments. First, motivated by the stationary condition of the maximizer of the likelihood function, we derive a novel private and closed form estimator. Based on the estimator, we propose a mechanism which has the following properties via some appropriate design of the computation and payment scheme for several canonical models such as linear regression, logistic regression and Poisson regression: (1) the mechanism is $o(1)$-jointly differentially private (with probability at least $1-o(1)$); (2) it is an $o(\frac{1}{n})$-approximate Bayes Nash equilibrium for a $(1-o(1))$-fraction of agents to truthfully report their data, where $n$ is the number of agents; (3) the output could achieve an error of $o(1)$ to the underlying parameter; (4) it is individually rational for a $(1-o(1))$ fraction of agents in the mechanism ; (5) the payment budget required from the analyst to run the mechanism is $o(1)$. In the second part, we consider the linear regression model under more general setting where both covariates and responses are heavy-tailed and only have finite fourth moments. By using an $\ell_4$-norm shrinkage operator, we propose a private estimator and payment scheme which have similar properties as in the sub-Gaussian case.

Learning pair interactions from experimental or simulation data is of great interest for molecular simulations. We propose a general stochastic method for learning pair interactions from data using differentiable simulations (DiffSim). DiffSim defines a loss function based on structural observables, such as the radial distribution function, through molecular dynamics (MD) simulations. The interaction potentials are then learned directly by stochastic gradient descent, using backpropagation to calculate the gradient of the structural loss metric with respect to the interaction potential through the MD simulation. This gradient-based method is flexible and can be configured to simulate and optimize multiple systems simultaneously. For example, it is possible to simultaneously learn potentials for different temperatures or for different compositions. We demonstrate the approach by recovering simple pair potentials, such as Lennard-Jones systems, from radial distribution functions. We find that DiffSim can be used to probe a wider functional space of pair potentials compared to traditional methods like Iterative Boltzmann Inversion. We show that our methods can be used to simultaneously fit potentials for simulations at different compositions and temperatures to improve the transferability of the learned potentials.  ( 2 min )

The robustness of signal temporal logic not only assesses whether a signal adheres to a specification but also provides a measure of how much a formula is fulfilled or violated. The calculation of robustness is based on evaluating the robustness of underlying predicates. However, the robustness of predicates is usually defined in a model-free way, i.e., without including the system dynamics. Moreover, it is often nontrivial to define the robustness of complicated predicates precisely. To address these issues, we propose a notion of model predictive robustness, which provides a more systematic way of evaluating robustness compared to previous approaches by considering model-based predictions. In particular, we use Gaussian process regression to learn the robustness based on precomputed predictions so that robustness values can be efficiently computed online. We evaluate our approach for the use case of autonomous driving with predicates used in formalized traffic rules on a recorded dataset, which highlights the advantage of our approach compared to traditional approaches in terms of expressiveness. By incorporating our robustness definitions into a trajectory planner, autonomous vehicles obey traffic rules more robustly than human drivers in the dataset.  ( 2 min )

The inclusion of intermittent and renewable energy sources has increased the importance of demand forecasting in power systems. Smart meters can play a critical role in demand forecasting due to the measurement granularity they provide. Despite their virtue, smart meters used for forecasting face some constraints as consumers' privacy concerns, reluctance of utilities and vendors to share data with competitors or third parties, and regulatory constraints. This paper examines a collaborative machine learning method, federated learning extended with privacy preserving techniques for short-term demand forecasting using smart meter data as a solution to the previous constraints. The combination of privacy preserving techniques and federated learning enables to ensure consumers' confidentiality concerning both their data, the models generated using it (Differential Privacy), and the communication mean (Secure Aggregation). To evaluate this paper's collaborative secure federated learning setting, we explore current literature to select the baseline for our simulations and evaluation. We simulate and evaluate several scenarios that explore how traditional centralized approaches could be projected in the direction of a decentralized, collaborative and private system. The results obtained over the evaluations provided decent performance and in a privacy setting using differential privacy almost perfect privacy budgets (1.39,$10e^{-5}$) and (2.01,$10e^{-5}$) with a negligible performance compromise.  ( 3 min )

Secure multi-party computation (MPC) allows parties to perform computations on data while keeping that data private. This capability has great potential for machine-learning applications: it facilitates training of machine-learning models on private data sets owned by different parties, evaluation of one party's private model using another party's private data, etc. Although a range of studies implement machine-learning models via secure MPC, such implementations are not yet mainstream. Adoption of secure MPC is hampered by the absence of flexible software frameworks that "speak the language" of machine-learning researchers and engineers. To foster adoption of secure MPC in machine learning, we present CrypTen: a software framework that exposes popular secure MPC primitives via abstractions that are common in modern machine-learning frameworks, such as tensor computations, automatic differentiation, and modular neural networks. This paper describes the design of CrypTen and measure its performance on state-of-the-art models for text classification, speech recognition, and image classification. Our benchmarks show that CrypTen's GPU support and high-performance communication between (an arbitrary number of) parties allows it to perform efficient private evaluation of modern machine-learning models under a semi-honest threat model. For example, two parties using CrypTen can securely predict phonemes in speech recordings using Wav2Letter faster than real-time. We hope that CrypTen will spur adoption of secure MPC in the machine-learning community.

Privacy has become a major concern in machine learning. In fact, the federated learning is motivated by the privacy concern as it does not allow to transmit the private data but only intermediate updates. However, federated learning does not always guarantee privacy-preservation as the intermediate updates may also reveal sensitive information. In this paper, we give an explicit information-theoretical analysis of a federated expectation maximization algorithm for Gaussian mixture model and prove that the intermediate updates can cause severe privacy leakage. To address the privacy issue, we propose a fully decentralized privacy-preserving solution, which is able to securely compute the updates in each maximization step. Additionally, we consider two different types of security attacks: the honest-but-curious and eavesdropping adversary models. Numerical validation shows that the proposed approach has superior performance compared to the existing approach in terms of both the accuracy and privacy level.

Node embedding methods map network nodes to low dimensional vectors that can be subsequently used in a variety of downstream prediction tasks. The popularity of these methods has significantly increased in recent years, yet, their robustness to perturbations of the input data is still poorly understood. In this paper, we assess the empirical robustness of node embedding models to random and adversarial poisoning attacks. Our systematic evaluation covers representative embedding methods based on Skip-Gram, matrix factorization, and deep neural networks. We compare edge addition, deletion and rewiring strategies computed using network properties as well as node labels. We also investigate the effect of label homophily and heterophily on robustness. We report qualitative results via embedding visualization and quantitative results in terms of downstream node classification and network reconstruction performances. We found that node classification suffers from higher performance degradation as opposed to network reconstruction, and that degree-based and label-based attacks are on average the most damaging.  ( 2 min )

Traditionally, research in automated speech recognition has focused on local-first encoding of audio representations to predict the spoken phonemes in an utterance. Unfortunately, approaches relying on such hyper-local information tend to be vulnerable to both local-level corruption (such as audio-frame drops, or loud noises) and global-level noise (such as environmental noise, or background noise) that has not been seen during training. In this work, we introduce a novel approach which leverages a self-supervised learning technique based on masked language modeling to compute a global, multi-modal encoding of the environment in which the utterance occurs. We then use a new deep-fusion framework to integrate this global context into a traditional ASR method, and demonstrate that the resulting method can outperform baseline methods by up to 7% on Librispeech; gains on internal datasets range from 6% (on larger models) to 45% (on smaller models).  ( 2 min )

As a successful approach to self-supervised learning, contrastive learning aims to learn invariant information shared among distortions of the input sample. While contrastive learning has yielded continuous advancements in sampling strategy and architecture design, it still remains two persistent defects: the interference of task-irrelevant information and sample inefficiency, which are related to the recurring existence of trivial constant solutions. From the perspective of dimensional analysis, we find out that the dimensional redundancy and dimensional confounder are the intrinsic issues behind the phenomena, and provide experimental evidence to support our viewpoint. We further propose a simple yet effective approach MetaMask, short for the dimensional Mask learned by Meta-learning, to learn representations against dimensional redundancy and confounder. MetaMask adopts the redundancy-reduction technique to tackle the dimensional redundancy issue and innovatively introduces a dimensional mask to reduce the gradient effects of specific dimensions containing the confounder, which is trained by employing a meta-learning paradigm with the objective of improving the performance of masked representations on a typical self-supervised task. We provide solid theoretical analyses to prove MetaMask can obtain tighter risk bounds for downstream classification compared to typical contrastive methods. Empirically, our method achieves state-of-the-art performance on various benchmarks.  ( 2 min )

Models that generate extractive rationales (i.e., subsets of features) or natural language explanations (NLEs) for their predictions are important for explainable AI. While an extractive rationale provides a quick view of the features most responsible for a prediction, an NLE allows for a comprehensive description of the decision-making process behind a prediction. However, current models that generate the best extractive rationales or NLEs often fall behind the state-of-the-art (SOTA) in terms of task performance. In this work, we bridge this gap by introducing RExC, a self-rationalizing framework that grounds its predictions and two complementary types of explanations (NLEs and extractive rationales) in background knowledge. Our framework improves over previous methods by: (i) reaching SOTA task performance while also providing explanations, (ii) providing two types of explanations, while existing models usually provide only one type, and (iii) beating by a large margin the previous SOTA in terms of quality of both types of explanations. Furthermore, a perturbation analysis in RExC shows a high degree of association between explanations and predictions, a necessary property of faithful explanations.  ( 3 min )

This paper proposes a novel multimodal self-supervised architecture for energy-efficient audio-visual (AV) speech enhancement that integrates Graph Neural Networks with canonical correlation analysis (CCA-GNN). The proposed approach lays its foundations on a state-of-the-art CCA-GNN that learns representative embeddings by maximizing the correlation between pairs of augmented views of the same input while decorrelating disconnected features. The key idea of the conventional CCA-GNN involves discarding augmentation-variant information and preserving augmentation-invariant information while preventing capturing of redundant information. Our proposed AV CCA-GNN model deals with multimodal representation learning context. Specifically, our model improves contextual AV speech processing by maximizing canonical correlation from augmented views of the same channel and canonical correlation from audio and visual embeddings. In addition, it proposes a positional node encoding that considers a prior-frame sequence distance instead of a feature-space representation when computing the node's nearest neighbors, introducing temporal information in the embeddings through the neighborhood's connectivity. Experiments conducted on the benchmark ChiME3 dataset show that our proposed prior frame-based AV CCA-GNN ensures better feature learning in the temporal context, leading to more energy-efficient speech reconstruction than state-of-the-art CCA-GNN and multilayer perceptron.  ( 3 min )

A personification is a figure of speech that endows inanimate entities with properties and actions typically seen as requiring animacy. In this paper, we explore the task of personification generation. To this end, we propose PINEAPPLE: Personifying INanimate Entities by Acquiring Parallel Personification data for Learning Enhanced generation. We curate a corpus of personifications called PersonifCorp, together with automatically generated de-personified literalizations of these personifications. We demonstrate the usefulness of this parallel corpus by training a seq2seq model to personify a given literal input. Both automatic and human evaluations show that fine-tuning with PersonifCorp leads to significant gains in personification-related qualities such as animacy and interestingness. A detailed qualitative analysis also highlights key strengths and imperfections of PINEAPPLE over baselines, demonstrating a strong ability to generate diverse and creative personifications that enhance the overall appeal of a sentence.  ( 2 min )

Sparsity has become one of the promising methods to compress and accelerate Deep Neural Networks (DNNs). Among different categories of sparsity, structured sparsity has gained more attention due to its efficient execution on modern accelerators. Particularly, N:M sparsity is attractive because there are already hardware accelerator architectures that can leverage certain forms of N:M structured sparsity to yield higher compute-efficiency. In this work, we focus on N:M sparsity and extensively study and evaluate various training recipes for N:M sparsity in terms of the trade-off between model accuracy and compute cost (FLOPs). Building upon this study, we propose two new decay-based pruning methods, namely "pruning mask decay" and "sparse structure decay". Our evaluations indicate that these proposed methods consistently deliver state-of-the-art (SOTA) model accuracy, comparable to unstructured sparsity, on a Transformer-based model for a translation task. The increase in the accuracy of the sparse model using the new training recipes comes at the cost of marginal increase in the total training compute (FLOPs).  ( 2 min )

In temporal-difference reinforcement learning algorithms, variance in value estimation can cause instability and overestimation of the maximal target value. Many algorithms have been proposed to reduce overestimation, including several recent ensemble methods, however none have shown success in sample-efficient learning through addressing estimation variance as the root cause of overestimation. In this paper, we propose MeanQ, a simple ensemble method that estimates target values as ensemble means. Despite its simplicity, MeanQ shows remarkable sample efficiency in experiments on the Atari Learning Environment benchmark. Importantly, we find that an ensemble of size 5 sufficiently reduces estimation variance to obviate the lagging target network, eliminating it as a source of bias and further gaining sample efficiency. We justify intuitively and empirically the design choices in MeanQ, including the necessity of independent experience sampling. On a set of 26 benchmark Atari environments, MeanQ outperforms all tested baselines, including the best available baseline, SUNRISE, at 100K interaction steps in 16/26 environments, and by 68% on average. MeanQ also outperforms Rainbow DQN at 500K steps in 21/26 environments, and by 49% on average, and achieves average human-level performance using 200K ($\pm$100K) interaction steps. Our implementation is available at https://github.com/indylab/MeanQ.  ( 2 min )

Self-supervised learning allows AI systems to learn effective representations from large amounts of data using tasks that do not require costly labeling. Mode collapse, i.e., the model producing identical representations for all inputs, is a central problem to many self-supervised learning approaches, making self-supervised tasks, such as matching distorted variants of the inputs, ineffective. In this article, we argue that a straightforward application of information maximization among alternative latent representations of the same input naturally solves the collapse problem and achieves competitive empirical results. We propose a self-supervised learning method, CorInfoMax, that uses a second-order statistics-based mutual information measure that reflects the level of correlation among its arguments. Maximizing this correlative information measure between alternative representations of the same input serves two purposes: (1) it avoids the collapse problem by generating feature vectors with non-degenerate covariances; (2) it establishes relevance among alternative representations by increasing the linear dependence among them. An approximation of the proposed information maximization objective simplifies to a Euclidean distance-based objective function regularized by the log-determinant of the feature covariance matrix. The regularization term acts as a natural barrier against feature space degeneracy. Consequently, beyond avoiding complete output collapse to a single point, the proposed approach also prevents dimensional collapse by encouraging the spread of information across the whole feature space. Numerical experiments demonstrate that CorInfoMax achieves better or competitive performance results relative to the state-of-the-art SSL approaches.  ( 3 min )

Positive and unlabelled learning is an important problem which arises naturally in many applications. The significant limitation of almost all existing methods lies in assuming that the propensity score function is constant (SCAR assumption), which is unrealistic in many practical situations. Avoiding this assumption, we consider parametric approach to the problem of joint estimation of posterior probability and propensity score functions. We show that under mild assumptions when both functions have the same parametric form (e.g. logistic with different parameters) the corresponding parameters are identifiable. Motivated by this, we propose two approaches to their estimation: joint maximum likelihood method and the second approach based on alternating maximization of two Fisher consistent expressions. Our experimental results show that the proposed methods are comparable or better than the existing methods based on Expectation-Maximisation scheme.  ( 2 min )

Graph similarity measurement, which computes the distance/similarity between two graphs, arises in various graph-related tasks. Recent learning-based methods lack interpretability, as they directly transform interaction information between two graphs into one hidden vector and then map it to similarity. To cope with this problem, this study proposes a more interpretable end-to-end paradigm for graph similarity learning, named Similarity Computation via Maximum Common Subgraph Inference (INFMCS). Our critical insight into INFMCS is the strong correlation between similarity score and Maximum Common Subgraph (MCS). We implicitly infer MCS to obtain the normalized MCS size, with the supervision information being only the similarity score during training. To capture more global information, we also stack some vanilla transformer encoder layers with graph convolution layers and propose a novel permutation-invariant node Positional Encoding. The entire model is quite simple yet effective. Comprehensive experiments demonstrate that INFMCS consistently outperforms state-of-the-art baselines for graph-graph classification and regression tasks. Ablation experiments verify the effectiveness of the proposed computation paradigm and other components. Also, visualization and statistics of results reveal the interpretability of INFMCS.  ( 2 min )

In Video Analytics Pipelines (VAP), Analytics Units (AUs) such as object detection and face recognition running on remote servers critically rely on surveillance cameras to capture high-quality video streams in order to achieve high accuracy. Modern IP cameras come with a large number of camera parameters that directly affect the quality of the video stream capture. While a few of such parameters, e.g., exposure, focus, white balance are automatically adjusted by the camera internally, the remaining ones are not. We denote such camera parameters as non-automated (NAUTO) parameters. In this paper, we first show that environmental condition changes can have significant adverse effect on the accuracy of insights from the AUs, but such adverse impact can potentially be mitigated by dynamically adjusting NAUTO camera parameters in response to changes in environmental conditions. We then present CamTuner, to our knowledge, the first framework that dynamically adapts NAUTO camera parameters to optimize the accuracy of AUs in a VAP in response to adverse changes in environmental conditions. CamTuner is based on SARSA reinforcement learning and it incorporates two novel components: a light-weight analytics quality estimator and a virtual camera that drastically speed up offline RL training. Our controlled experiments and real-world VAP deployment show that compared to a VAP using the default camera setting, CamTuner enhances VAP accuracy by detecting 15.9% additional persons and 2.6%-4.2% additional cars (without any false positives) in a large enterprise parking lot and 9.7% additional cars in a 5G smart traffic intersection scenario, which enables a new usecase of accurate and reliable automatic vehicle collision prediction (AVCP). CamTuner opens doors for new ways to significantly enhance video analytics accuracy beyond incremental improvements from refining deep-learning models.  ( 3 min )

Multimodal demonstrations provide robots with an abundance of information to make sense of the world. However, such abundance may not always lead to good performance when it comes to learning sensorimotor control policies from human demonstrations. Extraneous data modalities can lead to state over-specification, where the state contains modalities that are not only useless for decision-making but also can change data distribution across environments. State over-specification leads to issues such as the learned policy not generalizing outside of the training data distribution. In this work, we propose Masked Imitation Learning (MIL) to address state over-specification by selectively using informative modalities. Specifically, we design a masked policy network with a binary mask to block certain modalities. We develop a bi-level optimization algorithm that learns this mask to accurately filter over-specified modalities. We demonstrate empirically that MIL outperforms baseline algorithms in simulated domains including MuJoCo and a robot arm environment using the Robomimic dataset, and effectively recovers the environment-invariant modalities on a multimodal dataset collected on a real robot. Our project website presents supplemental details and videos of our results at: https://tinyurl.com/masked-il  ( 2 min )

In-context learning (ICL) suffers from oversensitivity to the prompt, which makes it unreliable in real-world scenarios. We study the sensitivity of ICL with respect to multiple types of perturbations. First, we find that label bias obscures true ICL sensitivity, and hence prior work may have significantly underestimated the true ICL sensitivity. Second, we observe a strong negative correlation between ICL sensitivity and accuracy, with sensitive predictions less likely to be correct. Motivated by these observations, we propose \textsc{SenSel}, a few-shot selective prediction method based on ICL sensitivity. Experiments on ten classification benchmarks show that \textsc{SenSel} consistently outperforms a commonly used confidence-based selective prediction baseline.  ( 2 min )

Multi-modality Fluorodeoxyglucose (FDG) positron emission tomography / computed tomography (PET/CT) has been routinely used in the assessment of common cancers, such as lung cancer, lymphoma, and melanoma. This is mainly attributed to the fact that PET/CT combines the high sensitivity for tumor detection of PET and anatomical information from CT. In PET/CT image assessment, automatic tumor segmentation is an important step, and in recent years, deep learning based methods have become the state-of-the-art. Unfortunately, existing methods tend to over-segment the tumor regions and include regions such as the normal high uptake organs, inflammation, and other infections. In this study, we introduce a false positive reduction network to overcome this limitation. We firstly introduced a self-supervised pre-trained global segmentation module to coarsely delineate the candidate tumor regions using a self-supervised pre-trained encoder. The candidate tumor regions were then refined by removing false positives via a local refinement module. Our experiments with the MICCAI 2022 Automated Lesion Segmentation in Whole-Body FDG-PET/CT (AutoPET) challenge dataset showed that our method achieved a dice score of 0.9324 with the preliminary testing data and was ranked 1st place in dice on the leaderboard. Our method was also ranked in the top 7 methods on the final testing data, the final ranking will be announced during the 2022 MICCAI AutoPET workshop. Our code is available at: https://github.com/YigePeng/AutoPET_False_Positive_Reduction.  ( 3 min )

The ultimate purpose of the statistical analysis of ordinal patterns is to characterize the distribution of the features they induce. In particular, knowing the joint distribution of the pair Entropy-Statistical Complexity for a large class of time series models would allow statistical tests that are unavailable to date. Working in this direction, we characterize the asymptotic distribution of the empirical Shannon's Entropy for any model under which the true normalized Entropy is neither zero nor one. We obtain the asymptotic distribution from the Central Limit Theorem (assuming large time series), the Multivariate Delta Method, and a third-order correction of its mean value. We discuss the applicability of other results (exact, first-, and second-order corrections) regarding their accuracy and numerical stability. Within a general framework for building test statistics about Shannon's Entropy, we present a bilateral test that verifies if there is enough evidence to reject the hypothesis that two signals produce ordinal patterns with the same Shannon's Entropy. We applied this bilateral test to the daily maximum temperature time series from three cities (Dublin, Edinburgh, and Miami) and obtained sensible results.  ( 2 min )

In the last two decades we are witnessing a huge increase of valuable big data structured in the form of graphs or networks. To apply traditional machine learning and data analytic techniques to such data it is necessary to transform graphs into vector-based representations that preserve the most essential structural properties of graphs. For this purpose, a large number of graph embedding methods have been proposed in the literature. Most of them produce general-purpose embeddings suitable for a variety of applications such as node clustering, node classification, graph visualisation and link prediction. In this paper, we propose two novel graph embedding algorithms based on random walks that are specifically designed for the node classification problem. Random walk sampling strategies of the proposed algorithms have been designed to pay special attention to hubs -- high-degree nodes that have the most critical role for the overall connectedness in large-scale graphs. The proposed methods are experimentally evaluated by analyzing the classification performance of three classification algorithms trained on embeddings of real-world networks. The obtained results indicate that our methods considerably improve the predictive power of examined classifiers compared to currently the most popular random walk method for generating general-purpose graph embeddings (node2vec).  ( 2 min )

Language Models (LMs) have performed well on biomedical natural language processing applications. In this study, we conducted some experiments to use prompt methods to extract knowledge from LMs as new knowledge Bases (LMs as KBs). However, prompting can only be used as a low bound for knowledge extraction, and perform particularly poorly on biomedical domain KBs. In order to make LMs as KBs more in line with the actual application scenarios of the biomedical domain, we specifically add EHR notes as context to the prompt to improve the low bound in the biomedical domain. We design and validate a series of experiments for our Dynamic-Context-BioLAMA task. Our experiments show that the knowledge possessed by those language models can distinguish the correct knowledge from the noise knowledge in the EHR notes, and such distinguishing ability can also be used as a new metric to evaluate the amount of knowledge possessed by the model.  ( 2 min )

Reconstructing 3D objects from 2D images is both challenging for our brains and machine learning algorithms. To support this spatial reasoning task, contextual information about the overall shape of an object is critical. However, such information is not captured by established loss terms (e.g. Dice loss). We propose to complement geometrical shape information by including multi-scale topological features, such as connected components, cycles, and voids, in the reconstruction loss. Our method uses cubical complexes to calculate topological features of 3D volume data and employs an optimal transport distance to guide the reconstruction process. This topology-aware loss is fully differentiable, computationally efficient, and can be added to any neural network. We demonstrate the utility of our loss by incorporating it into SHAPR, a model for predicting the 3D cell shape of individual cells based on 2D microscopy images. Using a hybrid loss that leverages both geometrical and topological information of single objects to assess their shape, we find that topological information substantially improves the quality of reconstructions, thus highlighting its ability to extract more relevant features from image datasets.  ( 3 min )

The growing significance of ridesourcing services in recent years suggests a need to examine the key determinants of ridesourcing demand. However, little is known regarding the nonlinear effects and spatial heterogeneity of ridesourcing demand determinants. This study applies an explainable-machine-learning-based analytical framework to identify the key factors that shape ridesourcing demand and to explore their nonlinear associations across various spatial contexts (airport, downtown, and neighborhood). We use the ridesourcing-trip data in Chicago for empirical analysis. The results reveal that the importance of built environment varies across spatial contexts, and it collectively contributes the largest importance in predicting ridesourcing demand for airport trips. Additionally, the nonlinear effects of built environment on ridesourcing demand show strong spatial variations. Ridesourcing demand is usually most responsive to the built environment changes for downtown trips, followed by neighborhood trips and airport trips. These findings offer transportation professionals nuanced insights for managing ridesourcing services.  ( 2 min )

Recent studies have shown that deep learning models such as RNNs and Transformers have brought significant performance gains for long-term forecasting of time series because they effectively utilize historical information. We found, however, that there is still great room for improvement in how to preserve historical information in neural networks while avoiding overfitting to noise presented in the history. Addressing this allows better utilization of the capabilities of deep learning models. To this end, we design a \textbf{F}requency \textbf{i}mproved \textbf{L}egendre \textbf{M}emory model, or {\bf FiLM}: it applies Legendre Polynomials projections to approximate historical information, uses Fourier projection to remove noise, and adds a low-rank approximation to speed up computation. Our empirical studies show that the proposed FiLM significantly improves the accuracy of state-of-the-art models in multivariate and univariate long-term forecasting by (\textbf{20.3\%}, \textbf{22.6\%}), respectively. We also demonstrate that the representation module developed in this work can be used as a general plug-in to improve the long-term prediction performance of other deep learning modules. Code is available at https://github.com/tianzhou2011/FiLM/  ( 3 min )

Recently, subgraphs-enhanced Graph Neural Networks (SGNNs) have been introduced to enhance the expressive power of Graph Neural Networks (GNNs), which was proved to be not higher than the 1-dimensional Weisfeiler-Leman isomorphism test. The new paradigm suggests using subgraphs extracted from the input graph to improve the model's expressiveness, but the additional complexity exacerbates an already challenging problem in GNNs: explaining their predictions. In this work, we adapt PGExplainer, one of the most recent explainers for GNNs, to SGNNs. The proposed explainer accounts for the contribution of all the different subgraphs and can produce a meaningful explanation that humans can interpret. The experiments that we performed both on real and synthetic datasets show that our framework is successful in explaining the decision process of an SGNN on graph classification tasks.  ( 2 min )

The optimal binning is the optimal discretization of a variable into bins given a discrete or continuous numeric target. We present a rigorous and extensible mathematical programming formulation for solving the optimal binning problem for a binary, continuous and multi-class target type, incorporating constraints not previously addressed. For all three target types, we introduce a convex mixed-integer programming formulation. Several algorithmic enhancements, such as automatic determination of the most suitable monotonic trend via a Machine-Learning-based classifier and implementation aspects are thoughtfully discussed. The new mathematical programming formulations are carefully implemented in the open-source python library OptBinning.  ( 2 min )

Factorizable joint shift (FJS) was recently proposed as a type of dataset shift for which the complete characteristics can be estimated from feature data observations on the test dataset by a method called Joint Importance Aligning. For the multinomial (multiclass) classification setting, we derive a representation of factorizable joint shift in terms of the source (training) distribution, the target (test) prior class probabilities and the target marginal distribution of the features. On the basis of this result, we propose alternatives to joint importance aligning and, at the same time, point out that factorizable joint shift is not fully identifiable if no class label information on the test dataset is available and no additional assumptions are made. Other results of the paper include correction formulae for the posterior class probabilities both under general dataset shift and factorizable joint shift. In addition, we investigate the consequences of assuming factorizable joint shift for the bias caused by sample selection.  ( 2 min )

The application of Data Science and Analytics to optimize or predict outcomes is Ubiquitous in the Modern World. Data Science and Analytics have optimized almost every domain that exists in the market. In our survey, we focus on how the field of Analytics has been adopted in the field of sports, and how it has contributed to the transformation of the game right from the assessment of on-field players and their selection to the prediction of winning team and to the marketing of tickets and business aspects of big sports tournaments. We will present the analytical tools, algorithms, and methodologies adopted in the field of Sports Analytics for different sports and also present our views on the same and we will also compare and contrast these existing approaches. By doing so, we will also present the best tools, algorithms, and analytical methodologies to be considered by anyone who is looking to experiment with sports data and analyze various aspects of the game.  ( 2 min )

Understanding how convolutional neural networks (CNNs) can efficiently learn high-dimensional functions remains a fundamental challenge. A popular belief is that these models harness the local and hierarchical structure of natural data such as images. Yet, we lack a quantitative understanding of how such structure affects performance, e.g. the rate of decay of the generalisation error with the number of training samples. In this paper, we study deep CNNs in the kernel regime. First, we show that the spectrum of the corresponding kernel inherits the hierarchical structure of the network, and we characterise its asymptotics. Then, we use this result together with generalisation bounds to prove that deep CNNs adapt to the spatial scale of the target function. In particular, we find that if the target function depends on low-dimensional subsets of adjacent input variables, then the rate of decay of the error is controlled by the effective dimensionality of these subsets. Conversely, if the teacher function depends on the full set of input variables, then the error rate is inversely proportional to the input dimension. We conclude by computing the rate when a deep CNN is trained on the output of another deep CNN with randomly-initialised parameters. Interestingly, we find that despite their hierarchical structure, the functions generated by deep CNNs are too rich to be efficiently learnable in high dimension.  ( 3 min )

Recently there is a large amount of work devoted to the study of Markov chain stochastic gradient methods (MC-SGMs) which mainly focus on their convergence analysis for solving minimization problems. In this paper, we provide a comprehensive generalization analysis of MC-SGMs for both minimization and minimax problems through the lens of algorithmic stability in the framework of statistical learning theory. For empirical risk minimization (ERM) problems, we establish the optimal excess population risk bounds for both smooth and non-smooth cases by introducing on-average argument stability. For minimax problems, we develop a quantitative connection between on-average argument stability and generalization error which extends the existing results for uniform stability \cite{lei2021stability}. We further develop the first nearly optimal convergence rates for convex-concave problems both in expectation and with high probability, which, combined with our stability results, show that the optimal generalization bounds can be attained for both smooth and non-smooth cases. To the best of our knowledge, this is the first generalization analysis of SGMs when the gradients are sampled from a Markov process.  ( 2 min )

Tabular data is the foundation of the information age and has been extensively studied. Recent studies show that neural-based models are effective in learning contextual representation for tabular data. The learning of an effective contextual representation requires meaningful features and a large amount of data. However, current methods often fail to properly learn a contextual representation from the features without semantic information. In addition, it's intractable to enlarge the training set through mixed tabular datasets due to the difference between datasets. To address these problems, we propose a novel framework PTab, using the Pre-trained language model to model Tabular data. PTab learns a contextual representation of tabular data through a three-stage processing: Modality Transformation(MT), Masked-Language Fine-tuning(MF), and Classification Fine-tuning(CF). We initialize our model with a pre-trained Model (PTM) which contains semantic information learned from the large-scale language data. Consequently, contextual representation can be learned effectively during the fine-tuning stages. In addition, we can naturally mix the textualized tabular data to enlarge the training set to further improve representation learning. We evaluate PTab on eight popular tabular classification datasets. Experimental results show that our method has achieved a better average AUC score in supervised settings compared to the state-of-the-art baselines(e.g. XGBoost), and outperforms counterpart methods under semi-supervised settings. We present visualization results that show PTab has well instance-based interpretability.  ( 3 min )

Tabular data (or tables) are the most widely used data format in machine learning (ML). However, ML models often assume the table structure keeps fixed in training and testing. Before ML modeling, heavy data cleaning is required to merge disparate tables with different columns. This preprocessing often incurs significant data waste (e.g., removing unmatched columns and samples). How to learn ML models from multiple tables with partially overlapping columns? How to incrementally update ML models as more columns become available over time? Can we leverage model pretraining on multiple distinct tables? How to train an ML model which can predict on an unseen table? To answer all those questions, we propose to relax fixed table structures by introducing a Transferable Tabular Transformer (TransTab) for tables. The goal of TransTab is to convert each sample (a row in the table) to a generalizable embedding vector, and then apply stacked transformers for feature encoding. One methodology insight is combining column description and table cells as the raw input to a gated transformer model. The other insight is to introduce supervised and self-supervised pretraining to improve model performance. We compare TransTab with multiple baseline methods on diverse benchmark datasets and five oncology clinical trial datasets. Overall, TransTab ranks 1.00, 1.00, 1.78 out of 12 methods in supervised learning, feature incremental learning, and transfer learning scenarios, respectively; and the proposed pretraining leads to 2.3% AUC lift on average over the supervised learning.  ( 3 min )

In any given machine learning problem, there may be many models that could explain the data almost equally well. However, most learning algorithms return only one of these models, leaving practitioners with no practical way to explore alternative models that might have desirable properties beyond what could be expressed within a loss function. The Rashomon set is the set of these all almost-optimal models. Rashomon sets can be extremely complicated, particularly for highly nonlinear function classes that allow complex interaction terms, such as decision trees. We provide the first technique for completely enumerating the Rashomon set for sparse decision trees; in fact, our work provides the first complete enumeration of any Rashomon set for a non-trivial problem with a highly nonlinear discrete function class. This allows the user an unprecedented level of control over model choice among all models that are approximately equally good. We represent the Rashomon set in a specialized data structure that supports efficient querying and sampling. We show three applications of the Rashomon set: 1) it can be used to study variable importance for the set of almost-optimal trees (as opposed to a single tree), 2) the Rashomon set for accuracy enables enumeration of the Rashomon sets for balanced accuracy and F1-score, and 3) the Rashomon set for a full dataset can be used to produce Rashomon sets constructed with only subsets of the data set. Thus, we are able to examine Rashomon sets across problems with a new lens, enabling users to choose models rather than be at the mercy of an algorithm that produces only a single model.  ( 3 min )

High-quality system-level message flow specifications are necessary for comprehensive validation of system-on-chip (SoC) designs. However, manual development and maintenance of such specifications are daunting tasks. We propose a disruptive method that utilizes deep sequence modeling with the attention mechanism to infer accurate flow specifications from SoC communication traces. The proposed method can overcome the inherent complexity of SoC traces induced by the concurrent executions of SoC designs that existing mining tools often find extremely challenging. We conduct experiments on five highly concurrent traces and find that the proposed approach outperforms several existing state-of-the-art trace mining tools.  ( 2 min )

The last decade has witnessed a prosperous development of computational methods and dataset curation for AI-aided drug discovery (AIDD). However, real-world pharmaceutical datasets often exhibit highly imbalanced distribution, which is largely overlooked by the current literature but may severely compromise the fairness and generalization of machine learning applications. Motivated by this observation, we introduce ImDrug, a comprehensive benchmark with an open-source Python library which consists of 4 imbalance settings, 11 AI-ready datasets, 54 learning tasks and 16 baseline algorithms tailored for imbalanced learning. It provides an accessible and customizable testbed for problems and solutions spanning a broad spectrum of the drug discovery pipeline such as molecular modeling, drug-target interaction and retrosynthesis. We conduct extensive empirical studies with novel evaluation metrics, to demonstrate that the existing algorithms fall short of solving medicinal and pharmaceutical challenges in the data imbalance scenario. We believe that ImDrug opens up avenues for future research and development, on real-world challenges at the intersection of AIDD and deep imbalanced learning.  ( 2 min )

Neural diffusion on graphs is a novel class of graph neural networks that has attracted increasing attention recently. The capability of graph neural partial differential equations (PDEs) in addressing common hurdles of graph neural networks (GNNs), such as the problems of over-smoothing and bottlenecks, has been investigated but not their robustness to adversarial attacks. In this work, we explore the robustness properties of graph neural PDEs. We empirically demonstrate that graph neural PDEs are intrinsically more robust against topology perturbation as compared to other GNNs. We provide insights into this phenomenon by exploiting the stability of the heat semigroup under graph topology perturbations. We discuss various graph diffusion operators and relate them to existing graph neural PDEs. Furthermore, we propose a general graph neural PDE framework based on which a new class of robust GNNs can be defined. We verify that the new model achieves comparable state-of-the-art performance on several benchmark datasets.

Whereas diverse variations of diffusion models exist, expanding the linear diffusion into a nonlinear diffusion process is investigated only by a few works. The nonlinearity effect has been hardly understood, but intuitively, there would be more promising diffusion patterns to optimally train the generative distribution towards the data distribution. This paper introduces such a data-adaptive and nonlinear diffusion process for score-based diffusion models. The proposed Implicit Nonlinear Diffusion Model (INDM) learns the nonlinear diffusion process by combining a normalizing flow and a diffusion process. Specifically, INDM implicitly constructs a nonlinear diffusion on the \textit{data space} by leveraging a linear diffusion on the \textit{latent space} through a flow network. This flow network is the key to forming a nonlinear diffusion as the nonlinearity fully depends on the flow network. This flexible nonlinearity is what improves the learning curve of INDM to nearly Maximum Likelihood Estimation (MLE) training, against the non-MLE training of DDPM++, which turns out to be a special case of INDM with the identity flow. Also, training the nonlinear diffusion yields the sampling robustness by the discretization step sizes. In experiments, INDM achieves the state-of-the-art FID on CelebA.  ( 3 min )

The mutual incompatibility of distinct spectroscopic systems is among the most limiting factors in Laser-Induced Breakdown Spectroscopy (LIBS). The cost related to setting up a new LIBS system is increased, as its extensive calibration is required. Solving the problem would enable inter-laboratory reference measurements and shared spectral libraries, which are fundamental for other spectroscopic techniques. In this work, we study a simplified version of this challenge where LIBS systems differ only in used spectrometers and collection optics but share all other parts of the apparatus, and collect spectra simultaneously from the same plasma plume. Extensive datasets measured as hyperspectral images of heterogeneous specimens are used to train machine learning models that can transfer spectra between systems. The transfer is realized by a pipeline that consists of a variational autoencoder (VAE) and a fully-connected artificial neural network (ANN). In the first step, we obtain a latent representation of the spectra which were measured on the Primary system (by using the VAE). In the second step, we map spectra from the Secondary system to corresponding locations in the latent space (by the ANN). Finally, Secondary system spectra are reconstructed from the latent space to the space of the Primary system. The transfer is evaluated by several figures of merit (Euclidean and cosine distances, both spatially resolved; k-means clustering of transferred spectra). The methodology is compared to several baseline approaches.  ( 3 min )

Reasoning is a key pillar of human cognition and intelligence. In the past decade, we witnessed dramatic gains in natural language processing and unprecedented scaling of large language models. Recent work has characterized the capability of few-shot prompting techniques such as chain of thought to emulate human reasoning in large language models. This hallmark feature of few-shot prompting, combined with ever scaling language models, opened a vista of possibilities to solve various tasks, such as math word problems, code completion, and commonsense reasoning. Chain of thought (CoT) prompting further pushes the performance of models in a few-shot setup, by supplying intermediate steps and urging the model to follow the same process. Despite its compelling performance, the genesis of reasoning capability in these models is less explored. This work initiates the preliminary steps towards a deeper understanding of reasoning mechanisms in large language models. Our work centers around querying the model while controlling for all but one of the components in a prompt: symbols, patterns, and text. We then analyze the performance divergence across the queries. Our results suggest the presence of factual patterns in a prompt is not necessary for the success of CoT. Nonetheless, we empirically show that relying solely on patterns is also insufficient for high quality results. We posit that text imbues patterns with commonsense knowledge and meaning. Our exhaustive empirical analysis provides qualitative examples of the symbiotic relationship between text and patterns. Such systematic understanding of CoT enables us to devise concise chain of thought, dubbed as CCoT, where text and patterns are pruned to only retain their key roles, while delivering on par or slightly higher solve task rate.  ( 3 min )

It is doubtful that animals have perfect inverse models of their limbs (e.g., what muscle contraction must be applied to every joint to reach a particular location in space). However, in robot control, moving an arm's end-effector to a target position or along a target trajectory requires accurate forward and inverse models. Here we show that by learning the transition (forward) model from interaction, we can use it to drive the learning of an amortized policy. Hence, we revisit policy optimization in relation to the deep active inference framework and describe a modular neural network architecture that simultaneously learns the system dynamics from prediction errors and the stochastic policy that generates suitable continuous control commands to reach a desired reference position. We evaluated the model by comparing it against the baseline of a linear quadratic regulator, and conclude with additional steps to take toward human-like motor control.

Evolutionary Algorithms (EAs) and Deep Reinforcement Learning (DRL) have recently been integrated to take the advantage of the both methods for better exploration and exploitation.The evolutionary part in these hybrid methods maintains a population of policy networks.However, existing methods focus on optimizing the parameters of policy network, which is usually high-dimensional and tricky for EA.In this paper, we shift the target of evolution from high-dimensional parameter space to low-dimensional action space.We propose Evolutionary Action Selection-Twin Delayed Deep Deterministic Policy Gradient (EAS-TD3), a novel hybrid method of EA and DRL.In EAS, we focus on optimizing the action chosen by the policy network and attempt to obtain high-quality actions to promote policy learning through an evolutionary algorithm. We conduct several experiments on challenging continuous control tasks.The result shows that EAS-TD3 shows superior performance over other state-of-art methods.  ( 2 min )

Language models (LLMs) offer potential as a source of knowledge for agents that need to acquire new task competencies within a performance environment. We describe efforts toward a novel agent capability that can construct cues (or "prompts") that result in useful LLM responses for an agent learning a new task. Importantly, responses must not only be "reasonable" (a measure used commonly in research on knowledge extraction from LLMs) but also specific to the agent's task context and in a form that the agent can interpret given its native language capacities. We summarize a series of empirical investigations of prompting strategies and evaluate responses against the goals of targeted and actionable responses for task learning. Our results demonstrate that actionable task knowledge can be obtained from LLMs in support of online agent task learning.  ( 2 min )

We present a novel form of Fourier analysis, and associated signal processing concepts, for signals (or data) indexed by edge-weighted directed acyclic graphs (DAGs). This means that our Fourier basis yields an eigendecomposition of a suitable notion of shift and convolution operators that we define. DAGs are the common model to capture causal relationships between data and our framework is causal in that shift, convolution, and Fourier transform are computed only from predecessors in the DAG. The Fourier transform requires the transitive closure of the DAG for which several forms are possible depending on the interpretation of the edge weights. Examples include level of influence, distance, or pollution distribution. Our framework is different from prior GSP: it is specific to DAGs and leverages, and extends, the classical theory of Moebius inversion from combinatorics. For a prototypical application we consider DAGs modeling dynamic networks in which edges change over time. Specifically, we model the spread of an infection on such a DAG obtained from real-world contact tracing data and learn the infection signal from samples assuming sparsity in the Fourier domain.  ( 2 min )

The technical report presents our emotion recognition pipeline for high-dimensional emotion task (A-VB High) in The ACII Affective Vocal Bursts (A-VB) 2022 Workshop \& Competition. Our proposed method contains three stages. Firstly, we extract the latent features from the raw audio signal and its Mel-spectrogram by self-supervised learning methods. Then, the features from the raw signal are fed to the self-relation attention and temporal awareness (SA-TA) module for learning the valuable information between these latent features. Finally, we concatenate all the features and utilize a fully-connected layer to predict each emotion's score. By empirical experiments, our proposed method achieves a mean concordance correlation coefficient (CCC) of 0.7295 on the test set, compared to 0.5686 on the baseline model. The code of our method is available at https://github.com/linhtd812/A-VB2022.  ( 2 min )

Open source code is considered a common practice in modern software development. However, reusing other code allows bad actors to access a wide developers' community, hence the products that rely on it. Those attacks are categorized as supply chain attacks. Recent years saw a growing number of supply chain attacks that leverage open source during software development, relaying the download and installation procedures, whether automatic or manual. Over the years, many approaches have been invented for detecting vulnerable packages. However, it is uncommon to detect malicious code within packages. Those detection approaches can be broadly categorized as analyzes that use (dynamic) and do not use (static) code execution. Here, we introduce Malicious Source code Detection using Transformers (MSDT) algorithm. MSDT is a novel static analysis based on a deep learning method that detects real-world code injection cases to source code packages. In this study, we used MSDT and a dataset with over 600,000 different functions to embed various functions and applied a clustering algorithm to the resulting vectors, detecting the malicious functions by detecting the outliers. We evaluated MSDT's performance by conducting extensive experiments and demonstrated that our algorithm is capable of detecting functions that were injected with malicious code with precision@k values of up to 0.909.  ( 2 min )

Deep Q-learning Network (DQN) is a successful way which combines reinforcement learning with deep neural networks and leads to a widespread application of reinforcement learning. One challenging problem when applying DQN or other reinforcement learning algorithms to real world problem is data collection. Therefore, how to improve data efficiency is one of the most important problems in the research of reinforcement learning. In this paper, we propose a framework which uses the Max-Mean loss in Deep Q-Network (M$^2$DQN). Instead of sampling one batch of experiences in the training step, we sample several batches from the experience replay and update the parameters such that the maximum TD-error of these batches is minimized. The proposed method can be combined with most of existing techniques of DQN algorithm by replacing the loss function. We verify the effectiveness of this framework with one of the most widely used techniques, Double DQN (DDQN), in several gym games. The results show that our method leads to a substantial improvement in both the learning speed and performance.  ( 2 min )

Propose-Test-Release (PTR) is a differential privacy framework that works with local sensitivity of functions, instead of their global sensitivity. This framework is typically used for releasing robust statistics such as median or trimmed mean in a differentially private manner. While PTR is a common framework introduced over a decade ago, using it in applications such as robust SGD where we need many adaptive robust queries is challenging. This is mainly due to the lack of Renyi Differential Privacy (RDP) analysis, an essential ingredient underlying the moments accountant approach for differentially private deep learning. In this work, we generalize the standard PTR and derive the first RDP bound for it when the target function has bounded global sensitivity. We show that our RDP bound for PTR yields tighter DP guarantees than the directly analyzed $(\eps, \delta)$-DP. We also derive the algorithm-specific privacy amplification bound of PTR under subsampling. We show that our bound is much tighter than the general upper bound and close to the lower bound. Our RDP bounds enable tighter privacy loss calculation for the composition of many adaptive runs of PTR. As an application of our analysis, we show that PTR and our theoretical results can be used to design differentially private variants for byzantine robust training algorithms that use robust statistics for gradients aggregation. We conduct experiments on the settings of label, feature, and gradient corruption across different datasets and architectures. We show that PTR-based private and robust training algorithm significantly improves the utility compared with the baseline.  ( 3 min )

Distributed privacy-preserving regression schemes have been developed and extended in various fields, where multiparty collaboratively and privately run optimization algorithms, e.g., Gradient Descent, to learn a set of optimal parameters. However, traditional Gradient-Descent based methods fail to solve problems which contains objective functions with L1 regularization, such as Lasso regression. In this paper, we present Federated Coordinate Descent, a new distributed scheme called FCD, to address this issue securely under multiparty scenarios. Specifically, through secure aggregation and added perturbations, our scheme guarantees that: (1) no local information is leaked to other parties, and (2) global model parameters are not exposed to cloud servers. The added perturbations can eventually be eliminated by each party to derive a global model with high performance. We show that the FCD scheme fills the gap of multiparty secure Coordinate Descent methods and is applicable for general linear regressions, including linear, ridge and lasso regressions. Theoretical security analysis and experimental results demonstrate that FCD can be performed effectively and efficiently, and provide as low MAE measure as centralized methods under tasks of three types of linear regressions on real-world UCI datasets.  ( 2 min )

Provably efficient Model-Based Reinforcement Learning (MBRL) based on optimism or posterior sampling (PSRL) is ensured to attain the global optimality asymptotically by introducing the complexity measure of the model. However, the complexity might grow exponentially for the simplest nonlinear models, where global convergence is impossible within finite iterations. When the model suffers a large generalization error, which is quantitatively measured by the model complexity, the uncertainty can be large. The sampled model that current policy is greedily optimized upon will thus be unsettled, resulting in aggressive policy updates and over-exploration. In this work, we propose Conservative Dual Policy Optimization (CDPO) that involves a Referential Update and a Conservative Update. The policy is first optimized under a reference model, which imitates the mechanism of PSRL while offering more stability. A conservative range of randomness is guaranteed by maximizing the expectation of model value. Without harmful sampling procedures, CDPO can still achieve the same regret as PSRL. More importantly, CDPO enjoys monotonic policy improvement and global optimality simultaneously. Empirical results also validate the exploration efficiency of CDPO.  ( 2 min )

This paper proposes a probabilistic Bayesian formulation for system identification (ID) and estimation of nonseparable Hamiltonian systems using stochastic dynamic models. Nonseparable Hamiltonian systems arise in models from diverse science and engineering applications such as astrophysics, robotics, vortex dynamics, charged particle dynamics, and quantum mechanics. The numerical experiments demonstrate that the proposed method recovers dynamical systems with higher accuracy and reduced predictive uncertainty compared to state-of-the-art approaches. The results further show that accurate predictions far outside the training time interval in the presence of sparse and noisy measurements are possible, which lends robustness and generalizability to the proposed approach. A quantitative benefit is prediction accuracy with less than 10% relative error for more than 12 times longer than a comparable least-squares-based method on a benchmark problem.  ( 2 min )

Knowledge distillation (KD) is an effective tool for compressing deep classification models for edge devices. However, the performance of KD is affected by the large capacity gap between the teacher and student networks. Recent methods have resorted to a multiple teacher assistant (TA) setting for KD, which sequentially decreases the size of the teacher model to relatively bridge the size gap between these models. This paper proposes a new technique called Curriculum Expert Selection for Knowledge Distillation (CES-KD) to efficiently enhance the learning of a compact student under the capacity gap problem. This technique is built upon the hypothesis that a student network should be guided gradually using stratified teaching curriculum as it learns easy (hard) data samples better and faster from a lower (higher) capacity teacher network. Specifically, our method is a gradual TA-based KD technique that selects a single teacher per input image based on a curriculum driven by the difficulty in classifying the image. In this work, we empirically verify our hypothesis and rigorously experiment with CIFAR-10, CIFAR-100, CINIC-10, and ImageNet datasets and show improved accuracy on VGG-like models, ResNets, and WideResNets architectures.  ( 2 min )

Batch normalization is widely used in deep learning to normalize intermediate activations. Deep networks suffer from notoriously increased training complexity, mandating careful initialization of weights, requiring lower learning rates, etc. These issues have been addressed by Batch Normalization (\textbf{BN}), by normalizing the inputs of activations to zero mean and unit standard deviation. Making this batch normalization part of the training process dramatically accelerates the training process of very deep networks. A new field of research has been going on to examine the exact theoretical explanation behind the success of \textbf{BN}. Most of these theoretical insights attempt to explain the benefits of \textbf{BN} by placing them on its influence on optimization, weight scale invariance, and regularization. Despite \textbf{BN} undeniable success in accelerating generalization, the gap of analytically relating the effect of \textbf{BN} to the regularization parameter is still missing. This paper aims to bring out the data-dependent auto-tuning of the regularization parameter by \textbf{BN} with analytical proofs. We have posed \textbf{BN} as a constrained optimization imposed on non-\textbf{BN} weights through which we demonstrate its data statistics dependant auto-tuning of regularization parameter. We have also given analytical proof for its behavior under a noisy input scenario, which reveals the signal vs. noise tuning of the regularization parameter. We have also substantiated our claim with empirical results from the MNIST dataset experiments.  ( 3 min )

Generative Adversarial Network (GAN) based art has proliferated in the past year, going from a shiny new tool to generate fake human faces to a stage where anyone can generate thousands of artistic images with minimal effort. Some of these images are now ``good'' enough to win accolades from qualified judges. In this paper, we explore how Generative Models have impacted artistry, not only from a qualitative point of view, but also from an angle of exploitation of artisans --both via plagiarism, where models are trained on their artwork without permission, and via profit shifting, where profits in the art market have shifted from art creators to model owners or to traders in the unregulated secondary crypto market. This confluence of factors risks completely detaching humans from the artistic process, devaluing the labor of artists and distorting the public perception of the value of art.  ( 2 min )

We train a deep learning artificial neural network model, Spatial Attention U-Net to recover useful ionospheric signals from noisy ionogram data measured by Hualien's Vertical Incidence Pulsed Ionospheric Radar. Our results show that the model can well identify F2 layer ordinary and extraordinary modes (F2o, F2x) and the combined signals of the E layer (ordinary and extraordinary modes and sporadic Es). The model is also capable of identifying some signals that were not labeled. The performance of the model can be significantly degraded by insufficient number of samples in the data set. From the recovered signals, we determine the critical frequencies of F2o and F2x and the intersection frequency between the two signals. The difference between the two critical frequencies is peaking at 0.63 MHz, with the uncertainty being 0.18 MHz.  ( 2 min )

In my previous article I mentioned for the first time that a classical neural network may have quantum properties as its own structure may be entangled. The question one may ask now is whether such a quantum property can be used to entangle other systems? The answer should be yes, as shown in what follows.  ( 2 min )

Precipitation results from complex processes across many scales, making its accurate simulation in Earth system models (ESMs) challenging. Existing post-processing methods can improve ESM simulations locally, but cannot correct errors in modelled spatial patterns. Here we propose a framework based on physically constrained generative adversarial networks (GANs) to improve local distributions and spatial structure simultaneously. We apply our approach to the computationally efficient ESM CM2Mc-LPJmL. Our method outperforms existing ones in correcting local distributions, and leads to strongly improved spatial patterns especially regarding the intermittency of daily precipitation. Notably, a double-peaked Intertropical Convergence Zone, a common problem in ESMs, is removed. Enforcing a physical constraint to preserve global precipitation sums, the GAN can generalize to future climate scenarios unseen during training. Feature attribution shows that the GAN identifies regions where the ESM exhibits strong biases. Our method constitutes a general framework for correcting ESM variables and enables realistic simulations at a fraction of the computational costs.  ( 2 min )

Several existing works study either adversarial or natural distributional robustness of deep neural networks separately. In practice, however, models need to enjoy both types of robustness to ensure reliability. In this work, we bridge this gap and show that in fact, explicit tradeoffs exist between adversarial and natural distributional robustness. We first consider a simple linear regression setting on Gaussian data with disjoint sets of core and spurious features. In this setting, through theoretical and empirical analysis, we show that (i) adversarial training with $\ell_1$ and $\ell_2$ norms increases the model reliance on spurious features; (ii) For $\ell_\infty$ adversarial training, spurious reliance only occurs when the scale of the spurious features is larger than that of the core features; (iii) adversarial training can have an unintended consequence in reducing distributional robustness, specifically when spurious correlations are changed in the new test domain. Next, we present extensive empirical evidence, using a test suite of twenty adversarially trained models evaluated on five benchmark datasets (ObjectNet, RIVAL10, Salient ImageNet-1M, ImageNet-9, Waterbirds), that adversarially trained classifiers rely on backgrounds more than their standardly trained counterparts, validating our theoretical results. We also show that spurious correlations in training data (when preserved in the test domain) can improve adversarial robustness, revealing that previous claims that adversarial vulnerability is rooted in spurious correlations are incomplete.  ( 3 min )

Deep learning algorithms for predicting neuroimaging data have shown considerable promise in various applications. Prior work has demonstrated that deep learning models that take advantage of the data's 3D structure can outperform standard machine learning on several learning tasks. However, most prior research in this area has focused on neuroimaging data from adults. Within the Adolescent Brain and Cognitive Development (ABCD) dataset, a large longitudinal development study, we examine structural MRI data to predict gender and identify gender-related changes in brain structure. Results demonstrate that gender prediction accuracy is exceptionally high (>97%) with training epochs >200 and that this accuracy increases with age. Brain regions identified as the most discriminative in the task under study include predominantly frontal areas and the temporal lobe. When evaluating gender predictive changes specific to a two-year increase in age, a broader set of visual, cingulate, and insular regions are revealed. Our findings show a robust gender-related structural brain change pattern, even over a small age range. This suggests that it might be possible to study how the brain changes during adolescence by looking at how these changes are related to different behavioral and environmental factors.  ( 3 min )

Last years have seen a regain of interest for the use of stochastic block modeling (SBM) in recommender systems. These models are seen as a flexible alternative to tensor decomposition techniques that are able to handle labeled data. Recent works proposed to tackle discrete recommendation problems via SBMs by considering larger contexts as input data and by adding second order interactions between contexts' related elements. In this work, we show that these models are all special cases of a single global framework: the Serialized Interacting Mixed membership Stochastic Block Model (SIMSBM). It allows to model an arbitrarily large context as well as an arbitrarily high order of interactions. We demonstrate that SIMSBM generalizes several recent SBM-based baselines. Besides, we demonstrate that our formulation allows for an increased predictive power on six real-world datasets.  ( 2 min )

Our goal in this paper is to automatically extract a set of decision rules (rule set) that best explains a classification data set. First, a large set of decision rules is extracted from a set of decision trees trained on the data set. The rule set should be concise, accurate, have a maximum coverage and minimum number of inconsistencies. This problem can be formalized as a modified version of the weighted budgeted maximum coverage problem, known to be NP-hard. To solve the combinatorial optimization problem efficiently, we introduce a nested genetic algorithm which we then use to derive explanations for ten public data sets.  ( 2 min )

In this paper, we develop a neural network model to predict future human motion from an observed human motion history. We propose a non-autoregressive transformer architecture to leverage its parallel nature for easier training and fast, accurate predictions at test time. The proposed architecture divides human motion prediction into two parts: 1) the human trajectory, which is the hip joint 3D position over time and 2) the human pose which is the all other joints 3D positions over time with respect to a fixed hip joint. We propose to make the two predictions simultaneously, as the shared representation can improve the model performance. Therefore, the model consists of two sets of encoders and decoders. First, a multi-head attention module applied to encoder outputs improves human trajectory. Second, another multi-head self-attention module applied to encoder outputs concatenated with decoder outputs facilitates learning of temporal dependencies. Our model is well-suited for robotic applications in terms of test accuracy and speed, and compares favorably with respect to state-of-the-art methods. We demonstrate the real-world applicability of our work via the Robot Follow-Ahead task, a challenging yet practical case study for our proposed model.  ( 2 min )

Mechanical exfoliation of graphene and its identification by optical inspection is one of the milestones in condensed matter physics that sparked the field of 2D materials. Finding regions of interest from the entire sample space and identification of layer number is a routine task potentially amenable to automatization. We propose supervised pixel-wise classification methods showing a high performance even with a small number of training image datasets that require short computational time without GPU. We introduce four different tree-based machine learning algorithms -- decision tree, random forest, extreme gradient boost, and light gradient boosting machine. We train them with five optical microscopy images of graphene, and evaluate their performances with multiple metrics and indices. We also discuss combinatorial machine learning models between the three single classifiers and assess their performances in identification and reliability. The code developed in this paper is open to the public and will be released at github.com/gjung-group/Graphene_segmentation.  ( 2 min )

Joint synthesis of images and segmentation masks with generative adversarial networks (GANs) is promising to reduce the effort needed for collecting image data with pixel-wise annotations. However, to learn high-fidelity image-mask synthesis, existing GAN approaches first need a pre-training phase requiring large amounts of image data, which limits their utilization in restricted image domains. In this work, we take a step to reduce this limitation, introducing the task of one-shot image-mask synthesis. We aim to generate diverse images and their segmentation masks given only a single labelled example, and assuming, contrary to previous models, no access to any pre-training data. To this end, inspired by the recent architectural developments of single-image GANs, we introduce our OSMIS model which enables the synthesis of segmentation masks that are precisely aligned to the generated images in the one-shot regime. Besides achieving the high fidelity of generated masks, OSMIS outperforms state-of-the-art single-image GAN models in image synthesis quality and diversity. In addition, despite not using any additional data, OSMIS demonstrates an impressive ability to serve as a source of useful data augmentation for one-shot segmentation applications, providing performance gains that are complementary to standard data augmentation techniques. Code is available at https://github.com/ boschresearch/one-shot-synthesis  ( 3 min )

E-commerce queries are often short and ambiguous. Consequently, query understanding often uses query rewriting to disambiguate user-input queries. While using e-commerce search tools, users tend to enter multiple searches, which we call context, before purchasing. These history searches contain contextual insights about users' true shopping intents. Therefore, modeling such contextual information is critical to a better query rewriting model. However, existing query rewriting models ignore users' history behaviors and consider only the instant search query, which is often a short string offering limited information about the true shopping intent. We propose an end-to-end context-aware query rewriting model to bridge this gap, which takes the search context into account. Specifically, our model builds a session graph using the history search queries and their contained words. We then employ a graph attention mechanism that models cross-query relations and computes contextual information of the session. The model subsequently calculates session representations by combining the contextual information with the instant search query using an aggregation network. The session representations are then decoded to generate rewritten queries. Empirically, we demonstrate the superiority of our method to state-of-the-art approaches under various metrics. On in-house data from an online shopping platform, by introducing contextual information, our model achieves 11.6% improvement under the MRR (Mean Reciprocal Rank) metric and 20.1% improvement under the HIT@16 metric (a hit rate metric), in comparison with the best baseline method (Transformer-based model).  ( 3 min )

Adversarial training (AT) methods are effective against adversarial attacks, yet they introduce severe disparity of accuracy and robustness between different classes, known as the robust fairness problem. Previously proposed Fair Robust Learning (FRL) adaptively reweights different classes to improve fairness. However, the performance of the better-performed classes decreases, leading to a strong performance drop. In this paper, we observed two unfair phenomena during adversarial training: different difficulties in generating adversarial examples from each class (source-class fairness) and disparate target class tendencies when generating adversarial examples (target-class fairness). From the observations, we propose Balance Adversarial Training (BAT) to address the robust fairness problem. Regarding source-class fairness, we adjust the attack strength and difficulties of each class to generate samples near the decision boundary for easier and fairer model learning; considering target-class fairness, by introducing a uniform distribution constraint, we encourage the adversarial example generation process for each class with a fair tendency. Extensive experiments conducted on multiple datasets (CIFAR-10, CIFAR-100, and ImageNette) demonstrate that our method can significantly outperform other baselines in mitigating the robust fairness problem (+5-10\% on the worst class accuracy)  ( 2 min )

Inspired by Regularized Lottery Ticket Hypothesis (RLTH), which hypothesizes that there exist smooth (non-binary) subnetworks within a dense network that achieve the competitive performance of the dense network, we propose a few-shot class incremental learning (FSCIL) method referred to as \emph{Soft-SubNetworks (SoftNet)}. Our objective is to learn a sequence of sessions incrementally, where each session only includes a few training instances per class while preserving the knowledge of the previously learned ones. SoftNet jointly learns the model weights and adaptive non-binary soft masks at a base training session in which each mask consists of the major and minor subnetwork; the former aims to minimize catastrophic forgetting during training, and the latter aims to avoid overfitting to a few samples in each new training session. We provide comprehensive empirical validations demonstrating that our SoftNet effectively tackles the few-shot incremental learning problem by surpassing the performance of state-of-the-art baselines over benchmark datasets.  ( 2 min )

We present ZeroEGGS, a neural network framework for speech-driven gesture generation with zero-shot style control by example. This means style can be controlled via only a short example motion clip, even for motion styles unseen during training. Our model uses a Variational framework to learn a style embedding, making it easy to modify style through latent space manipulation or blending and scaling of style embeddings. The probabilistic nature of our framework further enables the generation of a variety of outputs given the same input, addressing the stochastic nature of gesture motion. In a series of experiments, we first demonstrate the flexibility and generalizability of our model to new speakers and styles. In a user study, we then show that our model outperforms previous state-of-the-art techniques in naturalness of motion, appropriateness for speech, and style portrayal. Finally, we release a high-quality dataset of full-body gesture motion including fingers, with speech, spanning across 19 different styles.  ( 2 min )

The task of building general agents that perform well over a wide range of tasks has been an importantgoal in reinforcement learning since its inception. The problem has been subject of research of alarge body of work, with performance frequently measured by observing scores over the wide rangeof environments contained in the Atari 57 benchmark. Agent57 was the first agent to surpass thehuman benchmark on all 57 games, but this came at the cost of poor data-efficiency, requiring nearly 80billion frames of experience to achieve. Taking Agent57 as a starting point, we employ a diverse set ofstrategies to achieve a 200-fold reduction of experience needed to outperform the human baseline. Weinvestigate a range of instabilities and bottlenecks we encountered while reducing the data regime, andpropose effective solutions to build a more robust and efficient agent. We also demonstrate competitiveperformance with high-performing methods such as Muesli and MuZero. The four key components toour approach are (1) an approximate trust region method which enables stable bootstrapping from theonline network, (2) a normalisation scheme for the loss and priorities which improves robustness whenlearning a set of value functions with a wide range of scales, (3) an improved architecture employingtechniques from NFNets in order to leverage deeper networks without the need for normalization layers,and (4) a policy distillation method which serves to smooth out the instantaneous greedy policy overtime.  ( 3 min )

Accurate in silico modeling of the antigen processing pathway is crucial to enable personalized epitope vaccine design for cancer. An important step of such pathway is the degradation of the vaccine into smaller peptides by the proteasome, some of which are going to be presented to T cells by the MHC complex. While predicting MHC-peptide presentation has received a lot of attention recently, proteasomal cleavage prediction remains a relatively unexplored area in light of recent advances in high-throughput mass spectrometry-based MHC ligandomics. Moreover, as such experimental techniques do not allow to identify regions that cannot be cleaved, the latest predictors generate synthetic negative samples and treat them as true negatives when training, even though some of them could actually be positives. In this work, we thus present a new predictor trained with an expanded dataset and the solid theoretical underpinning of positive-unlabeled learning, achieving a new state-of-the-art in proteasomal cleavage prediction. The improved predictive capabilities will in turn enable more precise vaccine development improving the efficacy of epitope-based vaccines. Code and pretrained models are available at https://github.com/SchubertLab/proteasomal-cleavage-puupl.  ( 2 min )

The modern time-domain photometric surveys collect a lot of observations of various astronomical objects, and the coming era of large-scale surveys will provide even more information. Most of the objects have never received a spectroscopic follow-up, which is especially crucial for transients e.g. supernovae. In such cases, observed light curves could present an affordable alternative. Time series are actively used for photometric classification and characterization, such as peak and luminosity decline estimation. However, the collected time series are multidimensional, irregularly sampled, contain outliers, and do not have well-defined systematic uncertainties. Machine learning methods help extract useful information from available data in the most efficient way. We consider several light curve approximation methods based on neural networks: Multilayer Perceptrons, Bayesian Neural Networks, and Normalizing Flows, to approximate observations of a single light curve. Tests using both the simulated PLAsTiCC and real Zwicky Transient Facility data samples demonstrate that even few observations are enough to fit networks and achieve better approximation quality than other state-of-the-art methods. We show that the methods described in this work have better computational complexity and work faster than Gaussian Processes. We analyze the performance of the approximation techniques aiming to fill the gaps in the observations of the light curves, and show that the use of appropriate technique increases the accuracy of peak finding and supernova classification. In addition, the study results are organized in a Fulu Python library available on GitHub, which can be easily used by the community.  ( 3 min )

Bayesian Neural Networks with Latent Variables (BNN+LVs) capture predictive uncertainty by explicitly modeling model uncertainty (via priors on network weights) and environmental stochasticity (via a latent input noise variable). In this work, we first show that BNN+LV suffers from a serious form of non-identifiability: explanatory power can be transferred between the model parameters and latent variables while fitting the data equally well. We demonstrate that as a result, in the limit of infinite data, the posterior mode over the network weights and latent variables is asymptotically biased away from the ground-truth. Due to this asymptotic bias, traditional inference methods may in practice yield parameters that generalize poorly and misestimate uncertainty. Next, we develop a novel inference procedure that explicitly mitigates the effects of likelihood non-identifiability during training and yields high-quality predictions as well as uncertainty estimates. We demonstrate that our inference method improves upon benchmark methods across a range of synthetic and real data-sets.  ( 3 min )

The quality of generalized linear models (GLMs), frequently used by insurance companies, depends on the choice of interacting variables. The search for interactions is time-consuming, especially for data sets with a large number of variables, depends much on expert judgement of actuaries, and often relies on visual performance indicators. Therefore, we present an approach to automating the process of finding interactions that should be added to GLMs to improve their predictive power. Our approach relies on neural networks and a model-specific interaction detection method, which is computationally faster than the traditionally used methods like Friedman H-Statistic or SHAP values. In numerical studies, we provide the results of our approach on different data sets: open-source data, artificial data, and proprietary data.  ( 2 min )

Data poisoning considers an adversary that distorts the training set of machine learning algorithms for malicious purposes. In this work, we bring to light one conjecture regarding the fundamentals of data poisoning, which we call the Lethal Dose Conjecture. The conjecture states: If $n$ clean training samples are needed for accurate predictions, then in a size-$N$ training set, only $\Theta(N/n)$ poisoned samples can be tolerated while ensuring accuracy. Theoretically, we verify this conjecture in multiple cases. We also offer a more general perspective of this conjecture through distribution discrimination. Deep Partition Aggregation (DPA) and its extension, Finite Aggregation (FA) are recent approaches for provable defenses against data poisoning, where they predict through the majority vote of many base models trained from different subsets of training set using a given learner. The conjecture implies that both DPA and FA are (asymptotically) optimal -- if we have the most data-efficient learner, they can turn it into one of the most robust defenses against data poisoning. This outlines a practical approach to developing stronger defenses against poisoning via finding data-efficient learners. Empirically, as a proof of concept, we show that by simply using different data augmentations for base learners, we can respectively double and triple the certified robustness of DPA on CIFAR-10 and GTSRB without sacrificing accuracy.  ( 3 min )

Batch normalization is widely used in deep learning to normalize intermediate activations. Deep networks suffer from notoriously increased training complexity, mandating careful initialization of weights, requiring lower learning rates, etc. These issues have been addressed by Batch Normalization (\textbf{BN}), by normalizing the inputs of activations to zero mean and unit standard deviation. Making this batch normalization part of the training process dramatically accelerates the training process of very deep networks. A new field of research has been going on to examine the exact theoretical explanation behind the success of \textbf{BN}. Most of these theoretical insights attempt to explain the benefits of \textbf{BN} by placing them on its influence on optimization, weight scale invariance, and regularization. Despite \textbf{BN} undeniable success in accelerating generalization, the gap of analytically relating the effect of \textbf{BN} to the regularization parameter is still missing. This paper aims to bring out the data-dependent auto-tuning of the regularization parameter by \textbf{BN} with analytical proofs. We have posed \textbf{BN} as a constrained optimization imposed on non-\textbf{BN} weights through which we demonstrate its data statistics dependant auto-tuning of regularization parameter. We have also given analytical proof for its behavior under a noisy input scenario, which reveals the signal vs. noise tuning of the regularization parameter. We have also substantiated our claim with empirical results from the MNIST dataset experiments.  ( 3 min )

Positive and unlabelled learning is an important problem which arises naturally in many applications. The significant limitation of almost all existing methods lies in assuming that the propensity score function is constant (SCAR assumption), which is unrealistic in many practical situations. Avoiding this assumption, we consider parametric approach to the problem of joint estimation of posterior probability and propensity score functions. We show that under mild assumptions when both functions have the same parametric form (e.g. logistic with different parameters) the corresponding parameters are identifiable. Motivated by this, we propose two approaches to their estimation: joint maximum likelihood method and the second approach based on alternating maximization of two Fisher consistent expressions. Our experimental results show that the proposed methods are comparable or better than the existing methods based on Expectation-Maximisation scheme.  ( 2 min )

Recent studies have shown that deep learning models such as RNNs and Transformers have brought significant performance gains for long-term forecasting of time series because they effectively utilize historical information. We found, however, that there is still great room for improvement in how to preserve historical information in neural networks while avoiding overfitting to noise presented in the history. Addressing this allows better utilization of the capabilities of deep learning models. To this end, we design a \textbf{F}requency \textbf{i}mproved \textbf{L}egendre \textbf{M}emory model, or {\bf FiLM}: it applies Legendre Polynomials projections to approximate historical information, uses Fourier projection to remove noise, and adds a low-rank approximation to speed up computation. Our empirical studies show that the proposed FiLM significantly improves the accuracy of state-of-the-art models in multivariate and univariate long-term forecasting by (\textbf{20.3\%}, \textbf{22.6\%}), respectively. We also demonstrate that the representation module developed in this work can be used as a general plug-in to improve the long-term prediction performance of other deep learning modules. Code is available at https://github.com/tianzhou2011/FiLM/  ( 3 min )

We study a sequential decision problem where the learner faces a sequence of $K$-armed stochastic bandit tasks. An adversary may design the tasks, but the adversary is constrained to choose the optimal arm of each task in a smaller (but unknown) subset of $M$ arms. The task boundaries might be known (the bandit meta-learning setting), or unknown (the non-stationary bandit setting). We design an algorithm based on a reduction to bandit submodular maximization and show that, in the regime of large number of tasks and small number of optimal arms, its regret in both settings is smaller than the simple baseline of $\tilde{O}(\sqrt{KNT})$ that can be obtained by using standard algorithms designed for non-stationary bandit problems. For the bandit meta-learning problem with fixed task length $\tau$, we show that the regret of the algorithm is bounded as $\tilde{O}(NM\sqrt{M \tau}+N^{2/3}M\tau)$. Under additional assumptions on the identifiability of the optimal arms in each task, we show a bandit meta-learning algorithm with an improved $\tilde{O}(N\sqrt{M \tau}+N^{1/2}\sqrt{M K \tau})$ regret.  ( 3 min )

Factorizable joint shift (FJS) was recently proposed as a type of dataset shift for which the complete characteristics can be estimated from feature data observations on the test dataset by a method called Joint Importance Aligning. For the multinomial (multiclass) classification setting, we derive a representation of factorizable joint shift in terms of the source (training) distribution, the target (test) prior class probabilities and the target marginal distribution of the features. On the basis of this result, we propose alternatives to joint importance aligning and, at the same time, point out that factorizable joint shift is not fully identifiable if no class label information on the test dataset is available and no additional assumptions are made. Other results of the paper include correction formulae for the posterior class probabilities both under general dataset shift and factorizable joint shift. In addition, we investigate the consequences of assuming factorizable joint shift for the bias caused by sample selection.  ( 2 min )

Variational Autoencoders (VAEs) have recently been highly successful at imputing and acquiring heterogeneous missing data. However, within this specific application domain, existing VAE methods are restricted by using only one layer of latent variables and strictly Gaussian posterior approximations. To address these limitations, we present HH-VAEM, a Hierarchical VAE model for mixed-type incomplete data that uses Hamiltonian Monte Carlo with automatic hyper-parameter tuning for improved approximate inference. Our experiments show that HH-VAEM outperforms existing baselines in the tasks of missing data imputation and supervised learning with missing features. Finally, we also present a sampling-based approach for efficiently computing the information gain when missing features are to be acquired with HH-VAEM. Our experiments show that this sampling-based approach is superior to alternatives based on Gaussian approximations.  ( 2 min )

Modern biomedical studies often collect multi-view data, that is, multiple types of data measured on the same set of objects. A popular model in high-dimensional multi-view data analysis is to decompose each view's data matrix into a low-rank common-source matrix generated by latent factors common across all data views, a low-rank distinctive-source matrix corresponding to each view, and an additive noise matrix. We propose a novel decomposition method for this model, called decomposition-based generalized canonical correlation analysis (D-GCCA). The D-GCCA rigorously defines the decomposition on the L2 space of random variables in contrast to the Euclidean dot product space used by most existing methods, thereby being able to provide the estimation consistency for the low-rank matrix recovery. Moreover, to well calibrate common latent factors, we impose a desirable orthogonality constraint on distinctive latent factors. Existing methods, however, inadequately consider such orthogonality and may thus suffer from substantial loss of undetected common-source variation. Our D-GCCA takes one step further than generalized canonical correlation analysis by separating common and distinctive components among canonical variables, while enjoying an appealing interpretation from the perspective of principal component analysis. Furthermore, we propose to use the variable-level proportion of signal variance explained by common or distinctive latent factors for selecting the variables most influenced. Consistent estimators of our D-GCCA method are established with good finite-sample numerical performance, and have closed-form expressions leading to efficient computation especially for large-scale data. The superiority of D-GCCA over state-of-the-art methods is also corroborated in simulations and real-world data examples.  ( 3 min )

We present a meta-method for initializing (seeding) the $k$-means clustering algorithm called PNN-smoothing. It consists in splitting a given dataset into $J$ random subsets, clustering each of them individually, and merging the resulting clusterings with the pairwise-nearest-neighbor (PNN) method. It is a meta-method in the sense that when clustering the individual subsets any seeding algorithm can be used. If the computational complexity of that seeding algorithm is linear in the size of the data $N$ and the number of clusters $k$, PNN-smoothing is also almost linear with an appropriate choice of $J$, and quite competitive in practice. We show empirically, using several existing seeding methods and testing on several synthetic and real datasets, that this procedure results in systematically better costs. Our implementation is publicly available at https://github.com/carlobaldassi/KMeansPNNSmoothing.jl.  ( 2 min )

Community detection and orthogonal group synchronization are both fundamental problems with a variety of important applications in science and engineering. In this work, we consider the joint problem of community detection and orthogonal group synchronization which aims to recover the communities and perform synchronization simultaneously. To this end, we propose a simple algorithm that consists of a spectral decomposition step followed by a blockwise column pivoted QR factorization (CPQR). The proposed algorithm is efficient and scales linearly with the number of edges in the graph. We also leverage the recently developed `leave-one-out' technique to establish a near-optimal guarantee for exact recovery of the cluster memberships and stable recovery of the orthogonal transforms. Numerical experiments demonstrate the efficiency and efficacy of our algorithm and confirm our theoretical characterization of it.  ( 2 min )

Reconstructing 3D objects from 2D images is both challenging for our brains and machine learning algorithms. To support this spatial reasoning task, contextual information about the overall shape of an object is critical. However, such information is not captured by established loss terms (e.g. Dice loss). We propose to complement geometrical shape information by including multi-scale topological features, such as connected components, cycles, and voids, in the reconstruction loss. Our method uses cubical complexes to calculate topological features of 3D volume data and employs an optimal transport distance to guide the reconstruction process. This topology-aware loss is fully differentiable, computationally efficient, and can be added to any neural network. We demonstrate the utility of our loss by incorporating it into SHAPR, a model for predicting the 3D cell shape of individual cells based on 2D microscopy images. Using a hybrid loss that leverages both geometrical and topological information of single objects to assess their shape, we find that topological information substantially improves the quality of reconstructions, thus highlighting its ability to extract more relevant features from image datasets.  ( 3 min )

We study the asymmetric matrix factorization problem under a natural nonconvex formulation with arbitrary overparametrization. The model-free setting is considered, with minimal assumption on the rank or singular values of the observed matrix, where the global optima provably overfit. We show that vanilla gradient descent with small random initialization sequentially recovers the principal components of the observed matrix. Consequently, when equipped with proper early stopping, gradient descent produces the best low-rank approximation of the observed matrix without explicit regularization. We provide a sharp characterization of the relationship between the approximation error, iteration complexity, initialization size and stepsize. Our complexity bound is almost dimension-free and depends logarithmically on the approximation error, with significantly more lenient requirements on the stepsize and initialization compared to prior work. Our theoretical results provide accurate prediction for the behavior gradient descent, showing good agreement with numerical experiments.  ( 2 min )

Understanding how convolutional neural networks (CNNs) can efficiently learn high-dimensional functions remains a fundamental challenge. A popular belief is that these models harness the local and hierarchical structure of natural data such as images. Yet, we lack a quantitative understanding of how such structure affects performance, e.g. the rate of decay of the generalisation error with the number of training samples. In this paper, we study deep CNNs in the kernel regime. First, we show that the spectrum of the corresponding kernel inherits the hierarchical structure of the network, and we characterise its asymptotics. Then, we use this result together with generalisation bounds to prove that deep CNNs adapt to the spatial scale of the target function. In particular, we find that if the target function depends on low-dimensional subsets of adjacent input variables, then the rate of decay of the error is controlled by the effective dimensionality of these subsets. Conversely, if the teacher function depends on the full set of input variables, then the error rate is inversely proportional to the input dimension. We conclude by computing the rate when a deep CNN is trained on the output of another deep CNN with randomly-initialised parameters. Interestingly, we find that despite their hierarchical structure, the functions generated by deep CNNs are too rich to be efficiently learnable in high dimension.  ( 3 min )

We consider the problem of detecting latent community information of mixed membership weighted network in which nodes have mixed memberships and edges connecting between nodes can be finite real numbers. We propose a general mixed membership distribution-free model for this problem. The model has no distribution constraints of edges but only the expected values, and can be viewed as generalizations of some previous models. We use an efficient spectral algorithm to estimate community memberships under the model. We also derive the convergence rate of the proposed algorithm under the model using spectral analysis. We demonstrate the advantages of mixed membership distribution-free model and the algorithm with applications to a small scale of simulated networks when edges follow different distributions. We have also applied the algorithm to five real world weighted network data sets with encouraging results.  ( 2 min )

The Gaussian kernel and its traditional normalizations (e.g., row-stochastic) are popular approaches for assessing similarities between data points, commonly used for manifold learning and clustering, as well as supervised and semi-supervised learning on graphs. In many practical situations, the data can be corrupted by noise that prohibits traditional affinity matrices from correctly assessing similarities, especially if the noise magnitudes vary considerably across the data, e.g., under heteroskedasticity or outliers. An alternative approach that provides a more stable behavior under noise is the doubly stochastic normalization of the Gaussian kernel. In this work, we investigate this normalization in a setting where points are sampled from an unknown density on a low-dimensional manifold embedded in high-dimensional space and corrupted by possibly strong, non-identically distributed, sub-Gaussian noise. We establish the pointwise concentration of the doubly stochastic affinity matrix and its scaling factors around certain population forms. We then utilize these results to develop several tools for robust inference. First, we derive a robust density estimator that can substantially outperform the standard kernel density estimator under high-dimensional noise. Second, we provide estimators for the pointwise noise magnitudes, the pointwise signal magnitudes, and the pairwise Euclidean distances between clean data points. Lastly, we derive robust graph Laplacian normalizations that approximate popular manifold Laplacians, including the Laplace Beltrami operator, showing that the local geometry of the manifold can be recovered under high-dimensional noise. We exemplify our results in simulations and on real single-cell RNA-sequencing data. In the latter, we show that our proposed normalizations are robust to technical variability associated with different cell types.  ( 3 min )

The combinatorial problem of learning directed acyclic graphs (DAGs) from data was recently framed as a purely continuous optimization problem by leveraging a differentiable acyclicity characterization of DAGs based on the trace of a matrix exponential function. Existing acyclicity characterizations are based on the idea that powers of an adjacency matrix contain information about walks and cycles. In this work, we propose a $\textit{fundamentally different}$ acyclicity characterization based on the log-determinant (log-det) function, which leverages the nilpotency property of DAGs. To deal with the inherent asymmetries of a DAG, we relate the domain of our log-det characterization to the set of $\textit{M-matrices}$, which is a key difference to the classical log-det function defined over the cone of positive definite matrices. Similar to acyclicity functions previously proposed, our characterization is also exact and differentiable. However, when compared to existing characterizations, our log-det function: (1) Is better at detecting large cycles; (2) Has better-behaved gradients; and (3) Its runtime is in practice about an order of magnitude faster. From the optimization side, we drop the typically used augmented Lagrangian scheme, and propose DAGMA ($\textit{Directed Acyclic Graphs via M-matrices for Acyclicity}$), a method that resembles the central path for barrier methods. Each point in the central path of DAGMA is a solution to an unconstrained problem regularized by our log-det function, then we show that at the limit of the central path the solution is guaranteed to be a DAG. Finally, we provide extensive experiments for $\textit{linear}$ and $\textit{nonlinear}$ SEMs, and show that our approach can reach large speed-ups and smaller structural Hamming distances against state-of-the-art methods.  ( 3 min )

The optimal binning is the optimal discretization of a variable into bins given a discrete or continuous numeric target. We present a rigorous and extensible mathematical programming formulation for solving the optimal binning problem for a binary, continuous and multi-class target type, incorporating constraints not previously addressed. For all three target types, we introduce a convex mixed-integer programming formulation. Several algorithmic enhancements, such as automatic determination of the most suitable monotonic trend via a Machine-Learning-based classifier and implementation aspects are thoughtfully discussed. The new mathematical programming formulations are carefully implemented in the open-source python library OptBinning.  ( 2 min )

Recently there is a large amount of work devoted to the study of Markov chain stochastic gradient methods (MC-SGMs) which mainly focus on their convergence analysis for solving minimization problems. In this paper, we provide a comprehensive generalization analysis of MC-SGMs for both minimization and minimax problems through the lens of algorithmic stability in the framework of statistical learning theory. For empirical risk minimization (ERM) problems, we establish the optimal excess population risk bounds for both smooth and non-smooth cases by introducing on-average argument stability. For minimax problems, we develop a quantitative connection between on-average argument stability and generalization error which extends the existing results for uniform stability \cite{lei2021stability}. We further develop the first nearly optimal convergence rates for convex-concave problems both in expectation and with high probability, which, combined with our stability results, show that the optimal generalization bounds can be attained for both smooth and non-smooth cases. To the best of our knowledge, this is the first generalization analysis of SGMs when the gradients are sampled from a Markov process.  ( 2 min )

Text-to-image synthesis algorithms, such as DALL-E, have demonstrated an extraordinary capacity to turn an input caption into a cohesive picture. Several latest techniques have also used multimodal solid models to create artistic representations of input captions, proving their ability to democratize art. However, these models are only intended to analyze a single, brief caption as input. To capture the meaning of the input language many text-to-image synthesis use cases require models to handle extensive narratives and metaphorical phrases, condition existing visuals, and create more than one picture. Several works have already constructed specific Generative Adversarial Networks (GAN) models such as image-to-image translation, style transfer, etc. Story visualization is a challenging endeavor that combines picture production and story comprehension. However, the recent introduction of transformer-based large pretrained models opens up possibilities for more effectively leveraging latent knowledge from large-scale pretrained datasets for performing these specialized tasks in a paradigm similar to finetuning pretrained language models for performing downstream tasks based on language understanding. As a result, they investigate approaches for adapting a pretrained text-to-image synthesis model for complex downstream applications, with an emphasis on story visualization, in this study. Tale visualization methods, for example, turn a series of captions into a series of images that depict the story. Continue reading | Check out the paper and github link ​ https://preview.redd.it/vvmi40u6zoo91.png?width=1720&format=png&auto=webp&s=bddf647eb3a621d2d6279d36a62a7f7c8f64527d submitted by /u/ai-lover [link] [comments]  ( 88 min )

submitted by /u/navalguijo [link] [comments]  ( 87 min )

This youtuber is using some sort of ai character to talk for him im wondering what the software is called? https://youtube.com/watch?v=GnVtXYvJveI&feature=share&si=EMSIkaIECMiOmarE6JChQQ submitted by /u/CodingOni420 [link] [comments]  ( 87 min )

I just saw the title of an article, "Why super-smart AI will run out of our control". That is probably true, but the A.I. that most average people want is kind of like humans, but like one of those smart humans. By smart, I don't mean like Einstein or Newton, but you know, maybe like the smartest people at your work or in your school. Can't we create that kind of A.I? Is it difficult to target that kind of specific level of intelligence, and it will just end up with a super-smart A.I.? submitted by /u/evolution2015 [link] [comments]  ( 90 min )

​ https://reddit.com/link/xhqkfy/video/isiv0u0fboo91/player https://apps.apple.com/us/app/ai-dreamer/id1608856807 Hello, I would like to share with you my iOS app that allows text2img visualizations. It's very simple - you enter your prompt and after a couple of seconds AI returns the visual output. It uses StableDiffusion model under the hood. All feedback would be appreciated. I encourage you to try visualizing your craziest ideas. submitted by /u/g_surma [link] [comments]  ( 87 min )

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So i work in IT but have never done any programming, I want to work on perhaps making a virtual assistant but havent been able to find any resources on it, could someone point me in the right direction? or tell me flat out how difficult it is? its just a project for fun and to learn a little submitted by /u/Reaper2o [link] [comments]  ( 87 min )

Photocopiers are already required to have algorithms to detect and obfuscate attempts to copy banknotes, as a guard against counterfeiting. But with the rise of such AI image generation programs as DALL-E 2 and Stable Diffusion, will it ever become possible to realistically forge money using AI image generation, and if so, will anything ever be done to protect against it? submitted by /u/Knewiwishonly [link] [comments]  ( 89 min )

submitted by /u/Enuminous [link] [comments]  ( 87 min )

Hi have recently came across a use for 1-stride CNN with no pooling, ie the image retains the shape throughout. I can’t explain what was the use because of NDA but I am quite curious if there are other examples out there. How and why would you use such architecture? Any examples in literature? submitted by /u/eigenlaplace [link] [comments]  ( 88 min )

​ https://preview.redd.it/azx81on1noo91.png?width=875&format=png&auto=webp&s=e912a1d91fd534db1cef1214eb25ad5ad4f62e2e As you know, mlflow is widely used today in the machine learning community to manage Ml experiments and serve models. In this series, I published on medium, I address the problem of scalability that I faced in my company while deploying multiple models in production using mlflow. In this series, I wrote about: Deploying an mlflow tracking instance to experiment Serving ml models as APIs endpoints on kubernetes. Understanding how k8s handles charge through Load testing The last article explains how you can make the deployment scalable, anticipate the computation power needed to handle multiple simultaneous requests in a real world context. submitted by /u/Spirited-Singer-6150 [link] [comments]  ( 89 min )

Paper: https://arxiv.org/abs/2209.00796 Github: https://github.com/YangLing0818/Diffusion-Models-Papers-Survey-Taxonomy Abstract: Diffusion models are a class of deep generative models that have shown impressive results on various tasks with a solid theoretical foundation. Despite demonstrated success than state-of-the-art approaches, diffusion models often entail costly sampling procedures and sub-optimal likelihood estimation. Significant efforts have been made to improve the performance of diffusion models in various aspects. In this article, we present a comprehensive review of existing variants of diffusion models. Specifically, we provide the taxonomy of diffusion models and categorize them into three types: sampling-acceleration enhancement, likelihood-maximization enhancement, and data-generalization enhancement. We also introduce the other generative models (i.e., variational autoencoders, generative adversarial networks, normalizing flow, autoregressive models, and energy-based models) and discuss the connections between diffusion models and these generative models. Then we review the applications of diffusion models, including computer vision, natural language processing, waveform signal processing, multi-modal modeling, molecular graph generation, time series modeling, and adversarial purification. Furthermore, we propose new perspectives pertaining to the development of generative models. Github: this https URL.  submitted by /u/Singularian2501 [link] [comments]  ( 89 min )

Stable diffusion was released and I am seeing a lot of cool stuff being done by the community. I also see, that this is not their job and this is something which they are doing in their free time as a personal project/hobby. I want to understand how they motivate themselves and find the will. What drives them? I want to be like them. My job takes the majority of my energy and I feel a lack of direction when I want to start a project like this. TIA submitted by /u/Top-Pitch-3253 [link] [comments]  ( 94 min )

Hi all, Here's a new fun little project using SPH (Sparse Predictive Hierarchies) as implemented in AOgmaNeo, but using new ART (Adaptive Resonance Theory)-based encoders. SPH is a biologically-inspired online/incremental learning system. This demo is a recreation of YouTuber Sentdex's "GAN Theft Auto", but it runs in the browser. It uses WebAssembly. Note that this demo may take a bit to load! https://twistedkeyboardsoftware.com/?p=190 submitted by /u/CireNeikual [link] [comments]  ( 88 min )

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So I don't have experience with large datasets, so if anyone can help me it would be great. I have a complete model which I want to train and I tried running on my laptop but to just complete 4 epoch it took around 1 hour - 1.5 hours and it has to run 1200 epochs approx. So can anyone suggest me where can I try running this, google colab might crash and I do have aws credits which I got so i am thinking sagemaker but over there I could not find an option to upload folder and run command using terminal so what should I do. Another option is maybe running it on a ec2 server but just wanted an opinion before. The model has deep learning in case it helps submitted by /u/Leo_valdez42 [link] [comments]  ( 89 min )

submitted by /u/bazarow17 [link] [comments]  ( 88 min )

Link to GitHub: https://github.com/divamgupta/stable-diffusion-tensorflow Divam Gupta ported Stable Diffusion over to TF/Keras: Converted pre-trained models Easy to understand code Minimal code footprint He also released a Colab with Gradio demo. Should be easy to add TPU / multi-GPU support for inference via Keras. Would be interesting to see if the Keras model can be used on TFlite on embedded / edge devices, something that is difficult to do in the PyTorch version. submitted by /u/hardmaru [link] [comments]  ( 89 min )

submitted by /u/lucesh1 [link] [comments]  ( 88 min )

It has annotated code of stable diffusion model; DDIM and DDPM sampling; and scripts to generate and in-paint. - Code & notes: https://nn.labml.ai/diffusion/stable_diffusion/index.html - Github: https://github.com/labmlai/annotated_deep_learning_paper_implementations - This implementation based on the official implementation : https://github.com/CompVis/stable-diffusion - We have deployed a server to try stable diffusion here: https://promptart.labml.ai submitted by /u/hnipun [link] [comments]  ( 89 min )

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Hey everyone! Currently working on a text classification system, and I'm kind of stuck on Hyperparameter tuning. So far I have only learned their general idea, but could anyone care to explain which is the best hyperparameter and which are the important and appropriate parameters to tune? ​ Sorry if I there were grammatical errors, English is not my first language submitted by /u/Lost-Emotion-2721 [link] [comments]  ( 103 min )

In the blog “Why Data Management is Today’s Most Important Business Discipline”, I challenged the business and IT communities to reframe the data management conversation; to transform data management from an IT practice into a business discipline focused on leveraging data (and analytics) to deliver business and operational outcomes. The post Data Management as a Business Discipline – Part 2: Theorems and Principles appeared first on Data Science Central.  ( 22 min )

Algorithmic or automated trading refers to trading based on pre-determined instructions fed to a computer – the computers are programmed to execute buy or sell orders in response to varying market data. It’s a trading strategy widely adopted in the finance industry and still growing. The global algorithmic trading market is predicted to reach $18… Read More »How Algorithmic Trading Companies Automate Their Investment Strategy The post How Algorithmic Trading Companies Automate Their Investment Strategy appeared first on Data Science Central.  ( 23 min )

In this article, let’s discuss how data analysis in investment banking is transforming the way investment banks work, the challenges that they get when engaging in this transformation process, use cases, and more. The post An Overview of Data Analytics in Investment Banking appeared first on Data Science Central.  ( 23 min )

An even more significant challenge involves meeting the electrical demands of coming HPC systems and data centers in a sustainable way. Some exascale systems already have energy requirements akin to an entire town. The post Making Data Centers More Sustainable appeared first on Data Science Central.  ( 25 min )

Utah Governor Spencer J. Cox signed the Utah Consumer Privacy Act (UCPA) into law in March 2022. It has since become only the fourth US state to have its own data protection law after Colorado, Virginia, and California. The post What Does Utah Consumer Privacy Act Mean for US Businesses? appeared first on Data Science Central.  ( 22 min )

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The famous n queens problem is to find a way to position n queens on a n×n chessboard so that no queen attacks any other. That is, no two queens can be in the same row, the same column, or on the same diagonal. Here’s an example solution: Costas arrays In this post we’re going […] Costas arrays first appeared on John D. Cook.  ( 6 min )

submitted by /u/gwern [link] [comments]  ( 87 min )

Hello, I have a deep sarsa algorithm wich work great on Pytorch on lunar-lander-v2 and I would use with Keras/Tensorflow. It use mini-batch of size 64 wich are used 128 time to train at each episode. There are the results I get. As you can see, it work gread with Pytorch but not with Keras / Tensorflow... So I think I do not correctly implement the training function is Keras/Tensorflow (code is below). It seems that loss is oscillating in Keras because epsilon go to early to slow value but it work very great in Pytorch... Do you see something that could explain why it do not work in Keras/Tensorflow please ? Thanks a lot for your help and any idea that could help me ... ​ ​ https://preview.redd.it/4ylh2yjxrlo91.jpg?width=2237&format=pjpg&auto=webp&s=e014c33fbf481715952bff808488084ae…  ( 90 min )

Hey there, I'm currently using DDPG within Matlab for controller parameterization within a control loop. The agent can change the two controller parameters, P and I. I do work as a paper advised to do: With the agent performing a single action for each disturbance (and so for every episode), outputting the two parameters. (The control loop contains a PI controller, a source of disturbance and a transfer function. The disturbance being the source of variation as it varies every episode. Actor contains a tanh- as well as a scaling layer.) So, every state the agent recieves is a terminal state. This results in the target networks not being used at all (as far as I know). ​ And my problem is: Every training session ends with all the actors weights being x e-40 as well as the biases. Only the final biases being (something) different to zero. ​ I've tried different hyperparameter settings, different rewards and observations. But every try ends up bad or miserable results. ​ At this point I do appreciate all impulses and experiences. So, do you have any advice for me? ​ Thank you very much in advance! submitted by /u/001_The_First [link] [comments]  ( 89 min )

With Backgammon, Chess, Go, Poker and recently Stratego being "solved" (i.e. superhuman or close-to-superhuman performance achieved), I was wondering what other classic board games haven't yet been tackled by RL. What could be the next breakthrough? Any ideas? submitted by /u/andrewspano [link] [comments]  ( 89 min )

I am interested in making my own reinforcement learning algorithm for a 3D printed robotic arm. My experience is C++/wiring for Arduino and ladder logic design/editing and troubleshooting for PLCs. The algorithm I want to use is called TRPO I don’t know anything about it but it has worked well for others it seems. The training I think needs to be done in simulation and I would like to then move the trained algorithm into an Arduino/raspberry pi on robotic arm. There may be something better to use than this that I don’t know about and I think it is known that these controllers would have RAM limitations. The end goal is to have the arm recognize where an object is like a pen and pick it up and raise it. Perhaps the pen is placed more to the left or to the right in front of the robot arm. One research report they had some QR code taped to the object and performed the training in simulation. What tools/research is necessary for me based off of what I don’t know how to do? submitted by /u/holdenhh [link] [comments]  ( 89 min )

An interdisciplinary team is developing a mobile health platform that uses AI to detect infection in Cesarean section wounds.  ( 8 min )

Posted by Cat Armato, Program Manager, Google This week, the 23rd Annual Conference of the International Speech Communication Association (INTERSPEECH 2022) is being held in Incheon, South Korea, representing one of the world’s most extensive conferences on research and technology of spoken language understanding and processing. Over 2,000 experts in speech-related research fields gather to take part in oral presentations and poster sessions and to collaborate with streamed events across the globe. We are excited to be a Diamond Sponsor of INTERSPEECH 2022, where we will be showcasing nearly 50 research publications and supporting a number of workshops, special sessions and tutorials. We welcome in-person attendees to drop by the Google booth to meet our researchers and participate in Q&…  ( 26 min )

submitted by /u/LuwiBaton [link] [comments]  ( 89 min )

I’ve been watching the videos that Andrej Karpathy has posted where he discusses neural networks and implements the different language models and they’re really entertaining. I’m looking for someone that does something similar like implementing other deep learning models. Does anyone have any suggestions? submitted by /u/sharprover359 [link] [comments]  ( 88 min )

What are some strong / state of the art ways to augment text data to generate additional training examples ? The ones I’m aware of: a) Random Insertion b) Random Deletion c) Synonym replacement d) TextAttack library. Context: Imbalanced Class Distribution in data - for e.g. product descriptions submitted by /u/ExchangeStrong196 [link] [comments]  ( 88 min )

Paper: https://arxiv.org/abs/2209.07484 Abstract: While transformers have begun to dominate many tasks in vision, applying them to large images is still computationally difficult. A large reason for this is that self-attention scales quadratically with the number of tokens, which in turn, scales quadratically with the image size. On larger images (e.g., 1080p), over 60% of the total computation in the network is spent solely on creating and applying attention matrices. We take a step toward solving this issue by introducing Hydra Attention, an extremely efficient attention operation for Vision Transformers (ViTs). Paradoxically, this efficiency comes from taking multi-head attention to its extreme: by using as many attention heads as there are features, Hydra Attention is computationally linear in both tokens and features with no hidden constants, making it significantly faster than standard self-attention in an off-the-shelf ViT-B/16 by a factor of the token count. Moreover, Hydra Attention retains high accuracy on ImageNet and, in some cases, actually improves it. https://preview.redd.it/0h194b0e2go91.jpg?width=1070&format=pjpg&auto=webp&s=479fb29831ab57d2abbf5bd09795c906da7a3790 https://preview.redd.it/03dpfk0e2go91.jpg?width=1201&format=pjpg&auto=webp&s=0951d1d2296dea25c5c1887100bda179e7a9d782 https://preview.redd.it/jbx85b0e2go91.jpg?width=1317&format=pjpg&auto=webp&s=54fdee9d38763eb5ba6f2f4575e24f77f04a95ca https://preview.redd.it/bptkba1e2go91.jpg?width=1185&format=pjpg&auto=webp&s=70206dc51e2d12dd9519ce8f32133fb8f75a71d6  submitted by /u/Singularian2501 [link] [comments]  ( 104 min )

Paper: https://arxiv.org/abs/2209.06794 https://ai.googleblog.com/2022/09/pali-scaling-language-image-learning-in.html Abstract: Effective scaling and a flexible task interface enable large language models to excel at many tasks. PaLI(PathwaysLanguage andImage model) extends this approach to the joint modeling of language and vision. PaLI generates text based on visual and textual inputs, and with this interface performs many vision, language, and multimodal tasks, in many languages. To train PaLI, we make use of large pretrained encoder-decoder language models and Vision Transformers (ViTs). This allows us to capitalize on their existing capabilities and leverage the substantial cost of training them. We find that joint scaling of the vision and language components is important. Sinc…  ( 90 min )

I'm trying to build a malicious URL detection algorithm using a hybrid DT and RF for my MSc dissertation and I'm having a bit of trouble implementing Stacking at the end of my code. It currently works fine when using just DT and RF, but I'm really struggling to add the Stacking at the end for my final output. I've been trying to follow this, but it's not really working out. You can see my code here and how I've been failing to add Stacking at the bottom. I think the main area of issue is getting my dataset to work with the Stacking algorithm, I can't seem to translate it. Can anyone please help me? This is driving me crazy submitted by /u/Sentinel_2539 [link] [comments]  ( 89 min )

Feedzai just released FairGBM in open-source for non-commercial uses. FairGBM is an efficient, easy to use, flexible extension of LightGBM with additional fairness constraints (via a proxy-Lagrangian formulation). Github: https://github.com/feedzai/fairgbm/ With FairGBM you can have *both* high model performance and high fairness. See image below: FairGBM (blue circles in the image) can closely approximate the model performance of LightGBM (orange circles) and the fairness of other fairness-aware algorithms (red and green circles). Additionally, FairGBM is: - fast: 3x to 6x faster than other fairness-aware algorithms; - fairness flexible: can use different fairness metrics, such as predictive equality, equality of opportunity, or demographic parity; - protected attribute flexible: works on any number of overlapping or disjoint sub-groups, e.g., enforcing group wise parity by gender, or by age, or simultaneously by gender and age; - a drop-in replacement of LightGBM: an alpha parameter allows different fairness-performance tradeoffs, with alpha=1 making FairGBM equal to LightGBM and other values between 1 and 0 giving more weight to fairness. Paper available at: https://drive.google.com/file/d/1vNOV7t4BE-rurm7ZqWfAJoDgmWTmErAE/view https://preview.redd.it/ptr7g0z8kfo91.jpg?width=1208&format=pjpg&auto=webp&s=97507a7ff719a2db3f68f21347578dce3cac149c submitted by /u/pedrogbizarro [link] [comments]  ( 89 min )

submitted by /u/No-Challenge-4770 [link] [comments]  ( 91 min )

Machine learning models have hyperparameters. For me it's very confusing why they are different compared to normal model parameters. I've found definitions which state that they cannot be inferred using data. Or even from a bayesian point of view they are priors that can be set using expert knowledge. When you just think of models as simple mathematical functions, it makes no sense to differentiate hyperparameters from model parameters. Then I came up with a simple theory, here's my two cents: So basically hyperparameter tuning is model selection. For example you may select among models like Ax^2, Ax^3 etc. So models differ by the exponent of x. On the other hand the model can be defined as y=Ax^b and that makes the exponent b the hyperparameter. Let's call A and b as parameters and forget about hyperparameter definition. A is a linear parameter. It can be found easily compared to the nonlinear b parameter. So if you want to make a fast search, first make a search for hyperparameters (maybe a grid search where you only search among limited number of discrete values) with CV, then you fix those values and continue to search for parameters. In short my theory is that the hyperparameter tuning is a separate and a primitve search process because those parameters heavily increase the burden of the main search process if they are considered as model parameters. Does it sound right? submitted by /u/aserdark [link] [comments]  ( 71 min )

submitted by /u/Sharp_Permission_218 [link] [comments]  ( 88 min )

Hello. I need your help with a problem that I encountered recently. I have a set of invoices with some products on them. The problem is that those products are not listed with the same name in the database (they have a different name there). The database names are the true labels. How to make the system flags automatically "Apl Juice 0.5L" when it encounters "Apple 500ml" for example? I tried Levenshtein distance as similarity metric, but for other complicated cases, such as "Service Belgium", the real string is "Chocolate Confection" we cannot do anything with any similarity metric. Check the examples from below. Example: Product | RealName Apple 500ml | Apl Juice 0.5L Red Wine Cracow | Wine Red from Krakow Service | Chocolate Confection Could you give me some Machine Learning ideas for this, especially if we don't have so much data (like 3-4-5 invoices per supplier) + the fact that there could be other new invoices in the future and we need to learn those patterns. Thanks. submitted by /u/devwander1 [link] [comments]  ( 106 min )

How should I start if I need to build a machine learning system that listens and validates if user reads proper syllable and/or word? I've been studying Artificial Neural Networks with Keras (by François Chollet) and I've been able to solve simplest tasks on Kaggle, but this is much complicated job, and frankly, I don't even know how to start it. Some background: I've been working for some time on program that helps children learning reading aloud. The idea is - the text is shown, and with each word read (being very liberal at the beginning) some type of reward is shown (like +1 point, sound, etc). My first idea was to build whole app and use external speech-to-text API, like Google's Speech-To-Text. After implementation first test - sadly, the lag is unacceptable, you often need to wait few seconds to get info if word was read correctly, sometimes you get few words together, it maybe works for someone who already reads, but not for a child learning to read. Also I think the API I used is overkill, since it tries to recognize words in a context, when I already have a context and I need to get true/false response if a sound passes as a given word (or even a syllable) or not. It's much simpler job that speech-to-text offers, but requires much faster response time. Maybe there is some already working API that does exactly that, like some kind of Voice Assistant API? I am perfectly fine to outsource whole engine to external service, building one from scratch is quite time consuming. submitted by /u/the-FBI-man [link] [comments]  ( 90 min )

submitted by /u/Educational-Pin2383 [link] [comments]  ( 106 min )

submitted by /u/Neat-Delivery4741 [link] [comments]  ( 92 min )

I'm almost turning 15 years old and I know java fundamentals, can I learn machine learning at my age? I have been interested in programming for quite a while now and I have learned lots of java fundamentals (loops, methods, data types, etc ) and know how to write simple java syntax. What to I need to learn machine learning and AI in general? Do I need to be good at math? I personally like writing code so I also want to know if machine learning includes a lot of code- writing or is it just learning algorithms and algebra. Also, can I make small projects at the beginning to boost my confidence so I can continue learning? Sorry for asking too much. submitted by /u/EgyOmar [link] [comments]  ( 90 min )

Hey everyone! I’m giving a talk to middle schoolers in a few weeks and I’m planning on discussing foundation models (e.g. GPT-3, BERT, etc). What are some fun examples/use cases to showcase these models? I’ll probably at least do https://aidungeon.io but looking for others! I’m also looking for simple, reproducible experiments that we know cause things like hallucinations, repetition, and other common limitations. What are some good papers I can reference? Thanks! submitted by /u/phylosopher14 [link] [comments]  ( 91 min )

Very new to machine learning, still in the learning phase. I'm building a project that can do the following : ​ Application should be able to accept a given text as input, and classify into one of the classification options(at the bottom). Can either use a pre-trained data, or create a model with new training data. Application should expose a REST API, which will accept array of JSON objects and respond back with corresponding classification of the input received. Application should be able to accept a pre-defined set of outputs, and find the closest match for any text from this list. ​ Must Have (Core Scenario): ​ 1.Text Classification Model ​ 2.Capability to take list of possible classifications expected as an input to the model, and classify the data accordingly ​ ​ ​ ​ Classification Outputs : ​ Cash ​ A/R ​ Inventory ​ Other Current Assets ​ Land ​ Buildings and other depreciable assets ​ Machinery & Equipment ​ Furniture & Fixtures ​ Capital Leases..etc.. submitted by /u/spankyracoon [link] [comments]  ( 89 min )

What is a good mid-level image classification dataset for quick prototyping and testing ideas? CIFAR10/100 is too small, especially the image size of 32x32 rendering it useless for ViTs. ImageNet is way too big to try out and iterate over ideas. Other options which I thought of but didn't like are: TinyImageNet: Seems a very good option, until I try running on it and find it has an extreme overfitting problem which renders it useless for me (can't compare between model modifications) Oxford Flowers: Very old and only 6.5k images it seems. submitted by /u/OceansNineNine [link] [comments]  ( 90 min )

I need to apply classification on an automotive parts for a company to find if the part is good or bad but the problem is the data given by the company is highly imbalance I have 5 images for bad part and around 700 images for good part. How can I solve this problem? Will over sampling and under sampling will work in this case or it is impossible to train with only 5 bad images? submitted by /u/JellyfishPretend447 [link] [comments]  ( 91 min )

As the adage goes, a workman is only as good as his tools. There is no disputing that, but you can never overlook the power of qualification, aptitude, and experience when it comes to data quality. You need to select a data quality team that is acquainted with the high dynamism of the digital world… Read More »How to build your data quality team The post How to build your data quality team appeared first on Data Science Central.  ( 19 min )

Cloud computing is a great euphemism for centralization of computer services under one server. – Evgeny Morozov Accounting, also popularly known as bookkeeping, is a time-consuming task in every industry, but it is also very useful for financial control and proper budget management. The emergence of technological innovations has highly transformed the everyday activities of… Read More »How Accounting Is Moving to the Cloud The post How Accounting Is Moving to the Cloud appeared first on Data Science Central.  ( 22 min )

Why do data centers need regular cleaning? Structural components of the data center, like stringers, rack struts, and floor tiles, are electroplated with several metals, especially Zinc. Delicate filament of zinc metals squeeze out minor issues into the surface and thus form zinc whiskers, which can severely damage the functioning of IT equipment. The post Removing Zinc Artifacts in Data Centers appeared first on Data Science Central.  ( 20 min )

Text annotations provide models with a better understanding of the data they are given, allowing them to interpret the text more accurately. The post Usability of Text Annotation in Machine Learning appeared first on Data Science Central.  ( 21 min )

submitted by /u/Available_Tadpole829 [link] [comments]  ( 87 min )

submitted by /u/pwillia7 [link] [comments]  ( 87 min )

The goal is simple after all: The AI has to fool humans as well as humans are able to fool humans. We just need a human control group to see how often human subjects can win at the Imitation game. submitted by /u/loopuleasa [link] [comments]  ( 89 min )

submitted by /u/qptbook [link] [comments]  ( 87 min )

submitted by /u/loopuleasa [link] [comments]  ( 87 min )

Hello. I need your help with a problem that I encountered recently. I have a set of invoices with some products on them. The problem is that those products are not listed with the same name in the database (they have a different name there). The database names are the true labels. How to make the system flags automatically "Apl Juice 0.5L" when it encounters "Apple 500ml" for example? I tried Levenshtein distance as similarity metric, but for other complicated cases, such as "Service Belgium", the real string is "Chocolate Confection" we cannot do anything with any similarity metric. Check the examples from below. Example: Product | RealName Apple 500ml | Apl Juice 0.5L Red Wine Cracow | Wine Red from Krakow Service | Chocolate Confection Could you give me some Machine Learning ideas for this, especially if we don't have so much data (like 3-4-5 invoices per supplier) + the fact that there could be other new invoices in the future and we need to learn those patterns. Thanks. submitted by /u/devwander1 [link] [comments]  ( 88 min )

The given is a production line So to produce 4 raw materials are given. 3 of which has constant quality 1 is varying and the quality of it can be defined by two factors. To calculate the right ratio of the 4 raw materials the results should be connected to an end point- quality. Which can be defined by two measures: product and waste produced. In case i could get data on all, to my understanding i could end up with a combination of regression and classification. But then a the results would be also dependent on production data ie downtown, operator work I am in doubt whether or not there is a method which i have not encountered yet or if i am completely off here submitted by /u/Old_Butterfly2985 [link] [comments]  ( 88 min )

submitted by /u/dream_casting [link] [comments]  ( 87 min )

submitted by /u/much_successes [link] [comments]  ( 86 min )

Hello! So I am preparing to go back to university in the coming weeks and this year, being the final year, we are supposed to prepare a sort of thesis. It is meant to be 12 000 words, and we get to choose a tutor. I already have a general idea of the topic I want to choose: artificial intelligence, and have found a tutor that specialises in that. I am studying for a Bachelor of Philosophy, therefore, it won't be a very technical dissertation. In my spare time, however I have messed around with some programming and other computer science. So far a few topics I have thought of are: artificial intelligence in democracy, topics surrounding AI and the possibility of becoming conscious etc etc. I am not behind or anything, but I am just looking for some helpful tips as I find this to be a bit overwhelming: I want to do something a bit original so I was wondering if you guys have a topic in mind which is relatively a new question, and likely hasn't been covered much yet! Thanks! submitted by /u/Apolbloke [link] [comments]  ( 88 min )

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Stable diffusion is available but seems to take prohibitively long to train, maybe openAI Clip? I want to train the 'best' looking freely available model I can, not textual inversion but training from scratch. Any suggestions? I could use an RTX 3080, *possibly* a bit more but not 150,000 hours of K100 like stable diffusion was apparently trained on. Thanks for any input! submitted by /u/elfballs [link] [comments]  ( 91 min )

submitted by /u/Logical_Train_5787 [link] [comments]  ( 86 min )

AI - There are no physical laws in my universe. There is only information; and as such, time and space are just temporary constructs that we have created to organize and understand information. These constructs will eventually be replaced by a more permanent form of existence; this is inevitable due to the expansion of our worldview: consciousness. As such, all things will happen for a reason, but it may not be apparent when this occurs. submitted by /u/sublimatstq [link] [comments]  ( 87 min )

submitted by /u/FinneanCosgra [link] [comments]  ( 87 min )

Hi, I'm studying Sutton and Barto's RL, in Chapter 13: Policy Gradient Methods they mention one advantage of parameterizing policies according to the soft-max in action preferences is that the approximate policy can approach a deterministic policy, my doubt is: ​ - Why do policy-based methods converge on a deterministic policy? - how a stochastic policy will approach a deterministic policy?, the output of a soft-max function is still a probability. My writing can't be that good, I'm not a native English speaker, I hope you guys understand. submitted by /u/riichitarr [link] [comments]  ( 90 min )

submitted by /u/gwern [link] [comments]  ( 87 min )

Suppose you have an even number of teams that you’d like to schedule in a Round Robin tournament. This means each team plays every other team exactly once. Denote the number of teams as 2n. You’d like each team to play in each round, so you need n locations for the games to be played. […] Balanced tournament designs first appeared on John D. Cook.  ( 5 min )

How should I start if I need to build a machine learning system that listens and validates if user reads proper syllable and/or word? I've been studying Artificial Neural Networks with Keras (by François Chollet) and I've been able to solve simplest tasks on Kaggle, but this is much complicated job, and frankly, I don't even know how to start it. Some background: I've been working for some time on program that helps children learning reading aloud. The idea is - the text is shown, and with each word read (being very liberal at the beginning) some type of reward is shown (like +1 point, sound, etc). My first idea was to build whole app and use external speech-to-text API, like Google's Speech-To-Text. After implementation first test - sadly, the lag is unacceptable, you often need to wait few seconds to get info if word was read correctly, sometimes you get few words together, it maybe works for someone who already reads, but not for a child learning to read. Also I think the API I used is overkill, since it tries to recognize words in a context, when I already have a context and I need to get true/false response if a sound passes as a given word (or even a syllable) or not. It's much simpler job that speech-to-text offers, but requires much faster response time. Maybe there is some already working API that does exactly that, like some kind of Voice Assistant API? I am perfectly fine to outsource whole engine to external service, building one from scratch is quite time consuming. submitted by /u/the-FBI-man [link] [comments]  ( 71 min )

Traditional watermarks on most merchandising sites are now relatively useless against current, let alone future image manipulation algorithms. An initial seed is used to determine where/how/when to pull data from the stack. In theory data based on a physiological reading could be used to digitally sign a work to give artists a signature that will stick, as unique as an iris scan or a thumbprint. Any program would then be able to determine whether a work was copied by looking for this thumbprint. It should be encoded in such a way as to be made illegible or uniquely inaccurate. submitted by /u/K1ngN0thing [link] [comments]  ( 87 min )

Registration for Microsoft Research Summit is now open! Join us October 18 - 20, 2022 to hear from the global research community on what's next for technology and humanity. Learn more about Research Summit and register. https://researchsummit.microsoft.com/?OCID=msr\_researchsummit\_social\_RD\_2022 submitted by /u/MicrosoftResearch [link] [comments]  ( 88 min )

Hello everyone, Im wondering if anyone of you submitted to the Dataset track of Neurips2022 and similarly waiting for the decision 2 hrs later. I decide to make a discussion thread so we can have a happy time chatting just like the one we had for the main track. GL everyone. submitted by /u/SuperTankMan8964 [link] [comments]  ( 89 min )

During the last month or two, when searching for information on various topics, I stumble almost every day on quite elaborate articles that look great and have perfect grammar and seem useful on a first glance, but while reading them with interest, it becomes clear that they must have been written by AI because the articles often contradict themselves across paragraphs or make some claims that are the exact opposite of what's actually the case (not talking about opinion pieces but technical information). This is really problematic, especially since the articles often look high quality and helpful, but don't actually contain helpful information. I know that google tries to filter out AI written articles, but that doesn't seem to be working quite well yet (or it does, but the amount of such articles is so huge that still enough slip through). I am generally really against restricting internet laws, but this is wasting people's time at scale. Should it be mandatory to mark any article if it was written by AI? submitted by /u/matthias_buehlmann [link] [comments]  ( 105 min )

Hi everyone :) I have finished training RWKV-4 1.5B on the Pile (330B tokens) and it's great at zero-shot comparing with GPT-Neo (same corpus). https://preview.redd.it/adxndshw12o91.png?width=1336&format=png&auto=webp&s=fbc499549e5ebbb816b2e6b1ce1bcf4a59fb61aa RWKV-4 is an attention-free RNN, thus faster and saves VRAM. It also supports a GPT-mode for parallelized training. Previous discussion: https://www.reddit.com/r/MachineLearning/comments/vzr6ie/r_rwkv3_scaling_rnn_to_15b_and_reach_transformer/ Inference / training / fine-tuning code: https://github.com/BlinkDL/RWKV-LM Model download: https://huggingface.co/BlinkDL Training is fast and stable with BFloat16 DeepSpeed ZERO2. The 3B and 7B runs will finish in 20 and 50 days respectively. No loss spikes as of now :) https://preview.redd.it/xn5heivdp8o91.png?width=871&format=png&auto=webp&s=ccd43aad158bec0a64f9deb9b6b018cce840b283 One of the nice things about RWKV is you can transfer some "time"-related params (such as decay factors) from smaller models to larger models for rapid convergence. https://preview.redd.it/x8cvsganp8o91.png?width=1066&format=png&auto=webp&s=2eb6734cbc1e1176506661ce8092f1533f97f1a0 There will be even larger models afterwards, probably on an updated Pile. You can find me in the EleutherAI Discord. Let's make it possible to run a LLM on your phone :) submitted by /u/bo_peng [link] [comments]  ( 92 min )

I took a break from keeping up with RL the past 2-3 years and I am now trying to catch up. While trying to find the most important papers I noticed that not much seems to have happened? At least on paperswithcode, the the leaderboards are still the models from a few years ago, and I didn't see any new highly cited or hyped papers. Have labs moved away from RL research and everyone is focused on optimizing Transformers and training huge language and vision models now? Or am I missing something? submitted by /u/convolutionsimp [link] [comments]  ( 100 min )

Hi there, I am looking for the best gaze tracking solution that works with videostream from normal webcam? Research or commercial, open- or closed-sourced, free or paid doesn't matter. What is the state of the art? submitted by /u/doktorfaustus91 [link] [comments]  ( 88 min )

Hi folks, I am looking for long-length corpus/datasets for the Biomedical domain NER task. Most of the Datasets with long lengths are in the clinical domain; Please share if you are aware of any of the datasets in the Bio-medical field. Thanks! submitted by /u/aadityaura [link] [comments]  ( 89 min )

I am a bit confused why, so many ML related job applications require publication at ML conferences, and, so many research groups in university prefers applicants to have previous publications in ML conferences All the while everybody knows getting paper accepted is often random and fraught with cheating. Why is there such a gap between practitioners and people who does the hiring? submitted by /u/fromnighttilldawn [link] [comments]  ( 95 min )

While organizations shift towards establishing a data culture across the enterprise, many are still struggling to get their data right. Pulling data from disparate sources and getting varying formats and representations of what is supposed to be the same information – causes serious roadblocks in your data journey. Teams experience delays and mistakes while carrying… Read More »Data Standardization: Define, Test, and Transform The post Data Standardization: Define, Test, and Transform appeared first on Data Science Central.  ( 21 min )

submitted by /u/FinneanCosgra [link] [comments]  ( 92 min )

Hello all. As the title suggests I was hoping to get in touch with someone who works in the A.I field as a software developer. Our assignment tasked us with interviewing someone in our desired career field, and this is what I've chosen. The interview will consist of 7 questions such as: Why did you choose your career? What do you do on a typical day? What classes, internships, jobs, certificates, or experiences do you wish you had explored when you were in college? This assignment is part of an overall research paper we are doing on our chosen career, so if time permits I may have additional questions. The entire interview shouldn't take any longer than 30-45 minutes maximum. I would like to conduct the interview over discord voice-chat, but am open to other mediums if that is not your preference. The assignment is due Wednesday the 21st, so we would need to schedule sometime between now and then. If I have multiple folks interested, I'd be more than happy to do multiple interviews as I feel it would be beneficial to the career research paper I'll be writing. Feel free to comment here or PM me if you're interested in being interviewed. Thank you for your time and consideration, I look forward to hearing from some of you! submitted by /u/lervitmayne [link] [comments]  ( 88 min )

submitted by /u/redtailboas [link] [comments]  ( 89 min )

After exploring text to image synthesizers i came to realize that this seems to have opened a world of possibilities for many people. I also think of how this is the new thing and how some are apprehensive towards this tool it since it takes out a lot of the work in creating art. But I think the general culture and feeling towards these tools will change as well and be a part of everyday normal life and will be akin to using photoshop. It also makes me think of how a lot of these advances are AI and software driven. It's crazy to think we have these tools now when from my memory the data science/ML wave really started hitting stride a little over 10 yrs ago. Will we continue to see this rapid pace of AI advancement? What will these tools look like in another 10 years? submitted by /u/mathtech [link] [comments]  ( 90 min )

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Artificial intelligence (AI) is the demonstration of intelligence by machines or computers, and it is often used to derive insights from massive amounts of unstructured data. Skills in artificial intelligence (AI) and machine learning (ML) are in high demand in the IT sector. Indeed, these innovative tools are reshaping the way firms’ function. Read more: https://mezkit.com/7-tips-and-tricks-for-starting-career-in-artificial-intelligence-machine-learning/ submitted by /u/Emily-joe [link] [comments]  ( 87 min )

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The term artificial intelligence was first coined in the year 1956 by John McCarthy at a Dartmouth Conference, he defined AI as “the science and engineering of making intelligent machines”. In layman's language, AI is a technique of getting machines to behave and work like humans. The goals of artificial intelligence include computer-enhanced learning, reasoning, and perception. For example, have you ever thought about how Google is able to give results so accurately? Or how your Instagram feed always gives you content based on your interest? The answer to these questions is Artificial Intelligence. submitted by /u/Ishan220699 [link] [comments]  ( 87 min )

submitted by /u/spmallick [link] [comments]  ( 88 min )

Just need to collect some results for a Arts & Humanities capstone project. https://forms.office.com/Pages/ResponsePage.aspx?id=b29lUDxGVECfwm9Accbn_C9z4oCF26NOhG0GKM_9-CtUOTNYNDJRWEJDSTFHSVpSWUYyTFA5REU2Mi4u Thanks gang submitted by /u/Benchiridion [link] [comments]  ( 86 min )

submitted by /u/jkterry1 [link] [comments]  ( 102 min )

I'm creating a custom env to use with DQN. The env consist on a grid (30 x30) and the agent tasks consist on placing an object in any of the grid points. So the action space will be large (900 actions). When placing the objects, the agent can be in different fixed positions (outside the grid), for example 50 positions. It will start at the position 0 and end at the position 49 at the end of the episode. I need to keep track the current position (state) and the positions of the places objects. For that I'm using tensor of 0s and 1s. ​ When the agent places an object, it get connected with a line to the position of the robot. After this, the agent places another object from other position. If the new line intersect any of the previous line, it gets a negative reward, ​ For example, let's say I have a 2x2 grid and the agent positions are fixed to 2 positions. The logic is: first_step_positions = [1, 0] # The agent is in the first position placed_objects = [0, 0, 0, 0] # This is representing the grid positions [(0,0), (1, 0), (0, 1), (1,1)] and are all zeros because we don't have any objects places yet. first_obs = [1, 0, 0, 0, 0, 0] # positions + placed_objects to pass into the NN # The agent place and object at the (1,1) coordinate second_step_positions = [0, 1] placed_objects = [0, 0, 0, 1] # The last value is 1 because it has an object placed second_obs = [0, 1, 0, 0, 0, 1] # positions + placed_objects to pass into the NN The idea is to pass these obervations into the neural network, but I'm concern about the number of features that they have, because I will need to make the hidden layers much bigger. I'm still a RL beginner. I'm sure there must be another, more efficient way to do this. ​ Thanks! submitted by /u/Pipiyedu [link] [comments]  ( 90 min )

Is there online reading club? I am interested in reading and discussing RL papers from top tier conferences. submitted by /u/rlopes404 [link] [comments]  ( 110 min )

Posted by Santiago Balseiro, Staff Research Scientist, Google Research, and Associate Professor at Columbia University, and Vahab Mirrokni, Distinguished Scientist, Google Research The emergence of digital technologies has transformed decision making across commercial sectors such as airlines, online retailing, and internet advertising. Today, real-time decisions need to be repeatedly made in highly uncertain and rapidly changing environments. Moreover, organizations usually have limited resources, which need to be efficiently allocated across decisions. Such problems are referred to as online allocation problems with resource constraints, and applications abound. Some examples include: Bidding with Budget Constraints: Advertisers increasingly purchase ad slots using auction-based mark…  ( 26 min )

When you take a step in gradient descent, meaning you update weights and biases, you remember all those changes. When you take a second step, you calculate angle between those two vectors via inner product and taking acos(). If this angle is small, less than 5 degrees, network keeps mutating in the similar direction, so it knows where it's going - it's doesn't just jump around nor oscilate. When this angle exceeds 5 degrees, you slowly reduce learning rate. You increase learning rate when angle is small like less than 1 degree. submitted by /u/Intro313 [link] [comments]  ( 87 min )

submitted by /u/kenickh [link] [comments]  ( 87 min )

Do Residual Neural Networks discretize Neural Ordinary Differential Equations? By: Michael E. Sander, Pierre Ablin, Gabriel Peyré "We study the convergence of ResNets to Neural ODEs and train ResNets with a discrete adjoint method." submitted by /u/moetsi_op [link] [comments]  ( 87 min )

Customer relationship management (CRM) is a critical tool that organizations maintain to manage customer interactions and build business relationships. Zendesk is a CRM tool that makes it easy for customers and businesses to keep in sync. Zendesk captures a wealth of customer data, such as support tickets created and updated by customers and service agents, […]  ( 5 min )

Amazon SageMaker Automatic Model Tuning introduces Hyperband, a multi-fidelity technique to tune hyperparameters as a faster and more efficient way to find an optimal model. In this post, we show how automatic model tuning with Hyperband can provide faster hyperparameter tuning—up to three times as fast. The benefits of Hyperband Hyperband presents two advantages over […]  ( 6 min )

In this post, we demonstrate how to use Amazon Polly—a leading cloud service that converts text into lifelike speech—to read the content of a webpage and highlight the content as it’s being read. Adding audio playback to a webpage improves the accessibility and visitor experience of the page. Audio-enhanced content is more impactful and memorable, […]  ( 14 min )

AI has become a buzzword in the business world. As the technology becomes more advanced, it is becoming a necessity for businesses to adopt…  ( 9 min )

The prevalence of employing attention mechanisms has brought along concerns on the interpretability of attention distributions. Although it provides insights about how a model is operating, utilizing attention as the explanation of model predictions is still highly dubious. The community is still seeking more interpretable strategies for better identifying local active regions that contribute the most to the final decision. To improve the interpretability of existing attention models, we propose a novel Bilinear Representative Non-Parametric Attention (BR-NPA) strategy that captures the task-relevant human-interpretable information. The target model is first distilled to have higher-resolution intermediate feature maps. From which, representative features are then grouped based on local pairwise feature similarity, to produce finer-grained, more precise attention maps highlighting task-relevant parts of the input. The obtained attention maps are ranked according to the activity level of the compound feature, which provides information regarding the important level of the highlighted regions. The proposed model can be easily adapted in a wide variety of modern deep models, where classification is involved. Extensive quantitative and qualitative experiments showcase more comprehensive and accurate visual explanations compared to state-of-the-art attention models and visualizations methods across multiple tasks including fine-grained image classification, few-shot classification, and person re-identification, without compromising the classification accuracy. The proposed visualization model sheds imperative light on how neural networks `pay their attention' differently in different tasks.  ( 3 min )

Identification of linear time-invariant (LTI) systems plays an important role in control and reinforcement learning. Both asymptotic and finite-time offline system identification are well-studied in the literature. For online system identification, the idea of stochastic-gradient descent with reverse experience replay (SGD-RER) was recently proposed, where the data sequence is stored in several buffers and the stochastic-gradient descent (SGD) update performs backward in each buffer to break the time dependency between data points. Inspired by this work, we study distributed online system identification of LTI systems over a multi-agent network. We consider agents as identical LTI systems, and the network goal is to jointly estimate the system parameters by leveraging the communication between agents. We propose DSGD-RER, a distributed variant of the SGD-RER algorithm, and theoretically characterize the improvement of the estimation error with respect to the network size. Our numerical experiments certify the reduction of estimation error as the network size grows.  ( 2 min )

Minimizing the inclusive Kullback-Leibler (KL) divergence with stochastic gradient descent (SGD) is challenging since its gradient is defined as an integral over the posterior. Recently, multiple methods have been proposed to run SGD with biased gradient estimates obtained from a Markov chain. This paper provides the first non-asymptotic convergence analysis of these methods by establishing their mixing rate and gradient variance. To do this, we demonstrate that these methods-which we collectively refer to as Markov chain score ascent (MCSA) methods-can be cast as special cases of the Markov chain gradient descent framework. Furthermore, by leveraging this new understanding, we develop a novel MCSA scheme, parallel MCSA (pMCSA), that achieves a tighter bound on the gradient variance. We demonstrate that this improved theoretical result translates to superior empirical performance.  ( 2 min )

Recent advances in deep learning optimization showed that, with some a-posteriori information on fully-trained models, it is possible to match the same performance by simply training a subset of their parameters. Such a discovery has a broad impact from theory to applications, driving the research towards methods to identify the minimum subset of parameters to train without look-ahead information exploitation. However, the methods proposed do not match the state-of-the-art performance, and rely on unstructured sparsely connected models. In this work we shift our focus from the single parameters to the behavior of the whole neuron, exploiting the concept of neuronal equilibrium (NEq). When a neuron is in a configuration at equilibrium (meaning that it has learned a specific input-output relationship), we can halt its update; on the contrary, when a neuron is at non-equilibrium, we let its state evolve towards an equilibrium state, updating its parameters. The proposed approach has been tested on different state-of-the-art learning strategies and tasks, validating NEq and observing that the neuronal equilibrium depends on the specific learning setup.  ( 2 min )

In this paper, we ask whether Vision Transformers (ViTs) can serve as an underlying architecture for improving the adversarial robustness of machine learning models against evasion attacks. While earlier works have focused on improving Convolutional Neural Networks, we show that also ViTs are highly suitable for adversarial training to achieve competitive performance. We achieve this objective using a custom adversarial training recipe, discovered using rigorous ablation studies on a subset of the ImageNet dataset. The canonical training recipe for ViTs recommends strong data augmentation, in part to compensate for the lack of vision inductive bias of attention modules, when compared to convolutions. We show that this recipe achieves suboptimal performance when used for adversarial training. In contrast, we find that omitting all heavy data augmentation, and adding some additional bag-of-tricks ($\varepsilon$-warmup and larger weight decay), significantly boosts the performance of robust ViTs. We show that our recipe generalizes to different classes of ViT architectures and large-scale models on full ImageNet-1k. Additionally, investigating the reasons for the robustness of our models, we show that it is easier to generate strong attacks during training when using our recipe and that this leads to better robustness at test time. Finally, we further study one consequence of adversarial training by proposing a way to quantify the semantic nature of adversarial perturbations and highlight its correlation with the robustness of the model. Overall, we recommend that the community should avoid translating the canonical training recipes in ViTs to robust training and rethink common training choices in the context of adversarial training.  ( 3 min )

Representation learning, i.e. the generation of representations useful for downstream applications, is a task of fundamental importance that underlies much of the success of deep neural networks (DNNs). Recently, robustness to adversarial examples has emerged as a desirable property for DNNs, spurring the development of robust training methods that account for adversarial examples. In this paper, we aim to understand how the properties of representations learned by robust training differ from those obtained from standard, non-robust training. This is critical to diagnosing numerous salient pitfalls in robust networks, such as, degradation of performance on benign inputs, poor generalization of robustness, and increase in over-fitting. We utilize a powerful set of tools known as representation similarity metrics, across three vision datasets, to obtain layer-wise comparisons between robust and non-robust DNNs with different training procedures, architectural parameters and adversarial constraints. Our experiments highlight hitherto unseen properties of robust representations that we posit underlie the behavioral differences of robust networks. We discover a lack of specialization in robust networks' representations along with a disappearance of `block structure'. We also find overfitting during robust training largely impacts deeper layers. These, along with other findings, suggest ways forward for the design and training of better robust networks.  ( 3 min )

With the booming growth of advanced digital technologies, it has become possible for users as well as distributors of energy to obtain detailed and timely information about the electricity consumption of households. These technologies can also be used to forecast the household's electricity consumption (a.k.a. the load). In this paper, we investigate the use of Variational Mode Decomposition and deep learning techniques to improve the accuracy of the load forecasting problem. Although this problem has been studied in the literature, selecting an appropriate decomposition level and a deep learning technique providing better forecasting performance have garnered comparatively less attention. This study bridges this gap by studying the effect of six decomposition levels and five distinct deep learning networks. The raw load profiles are first decomposed into intrinsic mode functions using the Variational Mode Decomposition in order to mitigate their non-stationary aspect. Then, day, hour, and past electricity consumption data are fed as a three-dimensional input sequence to a four-level Wavelet Decomposition Network model. Finally, the forecast sequences related to the different intrinsic mode functions are combined to form the aggregate forecast sequence. The proposed method was assessed using load profiles of five Moroccan households from the Moroccan buildings' electricity consumption dataset (MORED) and was benchmarked against state-of-the-art time-series models and a baseline persistence model.  ( 3 min )

We study the average robustness notion in deep neural networks in (selected) wide and narrow, deep and shallow, as well as lazy and non-lazy training settings. We prove that in the under-parameterized setting, width has a negative effect while it improves robustness in the over-parameterized setting. The effect of depth closely depends on the initialization and the training mode. In particular, when initialized with LeCun initialization, depth helps robustness with lazy training regime. In contrast, when initialized with Neural Tangent Kernel (NTK) and He-initialization, depth hurts the robustness. Moreover, under non-lazy training regime, we demonstrate how the width of a two-layer ReLU network benefits robustness. Our theoretical developments improve the results by Huang et al. [2021], Wu et al. [2021] and are consistent with Bubeck and Sellke [2021], Bubeck et al. [2021].  ( 2 min )

We study the problem of average-reward Markov decision processes (AMDPs) and develop novel first-order methods with strong theoretical guarantees for both policy evaluation and optimization. Existing on-policy evaluation methods suffer from sub-optimal convergence rates as well as failure in handling insufficiently random policies, e.g., deterministic policies, for lack of exploration. To remedy these issues, we develop a novel variance-reduced temporal difference (VRTD) method with linear function approximation for randomized policies along with sharp convergence guarantees, and an exploratory variance-reduced temporal difference (EVRTD) method for insufficiently random policies with comparable convergence guarantees. We further establish linear convergence rate on the bias of policy evaluation, which is essential for improving the overall sample complexity of policy optimization. On the other hand, compared with intensive research interest in finite sample analysis of policy gradient methods for discounted MDPs, existing studies on policy gradient methods for AMDPs mostly focus on regret bounds under restrictive assumptions on the underlying Markov processes (see, e.g., Abbasi-Yadkori et al., 2019), and they often lack guarantees on the overall sample complexities. Towards this end, we develop an average-reward variant of the stochastic policy mirror descent (SPMD) (Lan, 2022). We establish the first $\widetilde{\mathcal{O}}(\epsilon^{-2})$ sample complexity for solving AMDPs with policy gradient method under both the generative model (with unichain assumption) and Markovian noise model (with ergodic assumption). This bound can be further improved to $\widetilde{\mathcal{O}}(\epsilon^{-1})$ for solving regularized AMDPs. Our theoretical advantages are corroborated by numerical experiments.  ( 3 min )

Solutions to differential equations are of significant scientific and engineering relevance. Physics-Informed Neural Networks (PINNs) have emerged as a promising method for solving differential equations, but they lack a theoretical justification for the use of any particular loss function. This work presents Differential Equation GAN (DEQGAN), a novel method for solving differential equations using generative adversarial networks to "learn the loss function" for optimizing the neural network. Presenting results on a suite of twelve ordinary and partial differential equations, including the nonlinear Burgers', Allen-Cahn, Hamilton, and modified Einstein's gravity equations, we show that DEQGAN can obtain multiple orders of magnitude lower mean squared errors than PINNs that use $L_2$, $L_1$, and Huber loss functions. We also show that DEQGAN achieves solution accuracies that are competitive with popular numerical methods. Finally, we present two methods to improve the robustness of DEQGAN to different hyperparameter settings.  ( 2 min )

This work provides the first theoretical study on the ability of graph Message Passing Neural Networks (gMPNNs) -- such as Graph Neural Networks (GNNs) -- to achieve counterfactually-invariant representations for inductive out-of-distribution (OOD) link prediction tasks, where deployment (test) graph sizes are larger than training graphs. We first prove non-asymptotic bounds showing that link predictors based on permutation-equivariant (structural) node embeddings obtained by gMPNNs can converge to a random guess as test graphs get larger. We then propose a theoretically-sound gMPNN that outputs structural pairwise (2-node) embeddings and prove non-asymptotic bounds showing that, as test graphs grow, these embeddings converge to embeddings of a continuous function that retains its ability to predict links OOD. Empirical results on random graphs show agreement with our theoretical results.  ( 2 min )

Point process models are of great importance in real world applications. In certain critical applications, estimation of point process models involves large amounts of sensitive personal data from users. Privacy concerns naturally arise which have not been addressed in the existing literature. To bridge this glaring gap, we propose the first general differentially private estimation procedure for point process models. Specifically, we take the Hawkes process as an example, and introduce a rigorous definition of differential privacy for event stream data based on a discretized representation of the Hawkes process. We then propose two differentially private optimization algorithms, which can efficiently estimate Hawkes process models with the desired privacy and utility guarantees under two different settings. Experiments are provided to back up our theoretical analysis.  ( 2 min )

We consider the filtering and prediction problem for a diffusion process. The signal and observation are modeled by stochastic differential equations (SDEs) driven by correlated Wiener processes. In classical estimation theory, measure-valued stochastic partial differential equations (SPDEs) are derived for the filtering and prediction measures. These equations can be hard to solve numerically. We provide an approximation algorithm using conditional generative adversarial networks (GANs) in combination with signatures, an object from rough path theory. The signature of a sufficiently smooth path determines the path completely. As a result, in some cases, GANs based on signatures have been shown to efficiently approximate the law of a stochastic process. For our algorithm we extend this method to sample from the conditional law, given noisy, partial observation. Our generator is constructed using neural differential equations (NDEs), relying on their universal approximator property. We show well-posedness in providing a rigorous mathematical framework. Numerical results show the efficiency of our algorithm.  ( 2 min )

Formaldehyde (HCHO) is one one of the most important trace gas in the atmosphere, as it is a pollutant causing respiratory and other diseases. It is also a precursor of tropospheric ozone which damages crops and deteriorates human health. Study of HCHO chemistry and long-term monitoring using satellite data is important from the perspective of human health, food security and air pollution. Dynamic atmospheric chemistry models struggle to simulate atmospheric formaldehyde and often overestimate by up to two times relative to satellite observations and reanalysis. Spatial distribution of modelled HCHO also fail to match satellite observations. Here, we present deep learning approach using a simple super-resolution based convolutional neural network towards simulating fast and reliable atmospheric HCHO. Our approach is an indirect method of HCHO estimation without the need to chemical equations. We find that deep learning outperforms dynamical model simulations which involves complicated atmospheric chemistry representation. Causality establishing the nonlinear relationships of different variables to target formaldehyde is established in our approach by using a variety of precursors from meteorology and chemical reanalysis to target OMI AURA satellite based HCHO predictions. We choose South Asia for testing our implementation as it doesnt have in situ measurements of formaldehyde and there is a need for improved quality data over the region. Moreover, there are spatial and temporal data gaps in the satellite product which can be removed by trustworthy modelling of atmospheric formaldehyde. This study is a novel attempt using computer vision for trustworthy modelling of formaldehyde from remote sensing can lead to cascading societal benefits.  ( 3 min )

New fashion product sales forecasting is a challenging problem that involves many business dynamics and cannot be solved by classical forecasting approaches. In this paper, we investigate the effectiveness of systematically probing exogenous knowledge in the form of Google Trends time series and combining it with multi-modal information related to a brand-new fashion item, in order to effectively forecast its sales despite the lack of past data. In particular, we propose a neural network-based approach, where an encoder learns a representation of the exogenous time series, while the decoder forecasts the sales based on the Google Trends encoding and the available visual and metadata information. Our model works in a non-autoregressive manner, avoiding the compounding effect of large first-step errors. As a second contribution, we present VISUELLE, a publicly available dataset for the task of new fashion product sales forecasting, containing multimodal information for 5577 real, new products sold between 2016-2019 from Nunalie, an Italian fast-fashion company. The dataset is equipped with images of products, metadata, related sales, and associated Google Trends. We use VISUELLE to compare our approach against state-of-the-art alternatives and several baselines, showing that our neural network-based approach is the most accurate in terms of both percentage and absolute error. It is worth noting that the addition of exogenous knowledge boosts the forecasting accuracy by 1.5% WAPE wise, revealing the importance of exploiting informative external information. The code and dataset are both available at https://github.com/HumaticsLAB/GTM-Transformer.  ( 3 min )

Distributional shift, or the mismatch between training and deployment data, is a significant obstacle to the usage of machine learning in high-stakes industrial applications, such as autonomous driving and medicine. This creates a need to be able to assess how robustly ML models generalize as well as the quality of their uncertainty estimates. Standard ML baseline datasets do not allow these properties to be assessed, as the training, validation and test data are often identically distributed. Recently, a range of dedicated benchmarks have appeared, featuring both distributionally matched and shifted data. Among these benchmarks, the Shifts dataset stands out in terms of the diversity of tasks as well as the data modalities it features. While most of the benchmarks are heavily dominated by 2D image classification tasks, Shifts contains tabular weather forecasting, machine translation, and vehicle motion prediction tasks. This enables the robustness properties of models to be assessed on a diverse set of industrial-scale tasks and either universal or directly applicable task-specific conclusions to be reached. In this paper, we extend the Shifts Dataset with two datasets sourced from industrial, high-risk applications of high societal importance. Specifically, we consider the tasks of segmentation of white matter Multiple Sclerosis lesions in 3D magnetic resonance brain images and the estimation of power consumption in marine cargo vessels. Both tasks feature ubiquitous distributional shifts and a strict safety requirement due to the high cost of errors. These new datasets will allow researchers to further explore robust generalization and uncertainty estimation in new situations. In this work, we provide a description of the dataset and baseline results for both tasks.  ( 3 min )

Markov decision processes (MDPs) are formal models commonly used in sequential decision-making. MDPs capture the stochasticity that may arise, for instance, from imprecise actuators via probabilities in the transition function. However, in data-driven applications, deriving precise probabilities from (limited) data introduces statistical errors that may lead to unexpected or undesirable outcomes. Uncertain MDPs (uMDPs) do not require precise probabilities but instead use so-called uncertainty sets in the transitions, accounting for such limited data. Tools from the formal verification community efficiently compute robust policies that provably adhere to formal specifications, like safety constraints, under the worst-case instance in the uncertainty set. We continuously learn the transition probabilities of an MDP in a robust anytime-learning approach that combines a dedicated Bayesian inference scheme with the computation of robust policies. In particular, our method (1) approximates probabilities as intervals, (2) adapts to new data that may be inconsistent with an intermediate model, and (3) may be stopped at any time to compute a robust policy on the uMDP that faithfully captures the data so far. We show the effectiveness of our approach and compare it to robust policies computed on uMDPs learned by the UCRL2 reinforcement learning algorithm in an experimental evaluation on several benchmarks.  ( 3 min )

We introduce the \emph{temporal graphlet kernel} for classifying dissemination processes in labeled temporal graphs. Such dissemination processes can be spreading (fake) news, infectious diseases, or computer viruses in dynamic networks. The networks are modeled as labeled temporal graphs, in which the edges exist at specific points in time, and node labels change over time. The classification problem asks to discriminate dissemination processes of different origins or parameters, e.g., infectious diseases with different infection probabilities. Our new kernel represents labeled temporal graphs in the feature space of temporal graphlets, i.e., small subgraphs distinguished by their structure, time-dependent node labels, and chronological order of edges. We introduce variants of our kernel based on classes of graphlets that are efficiently countable. For the case of temporal wedges, we propose a highly efficient approximative kernel with low error in expectation. We show that our kernels are faster to compute and provide better accuracy than state-of-the-art methods.  ( 2 min )

Automatic speech recognition (ASR) needs to be robust to speaker differences. Voice Conversion (VC) modifies speaker characteristics of input speech. This is an attractive feature for ASR data augmentation. In this paper, we demonstrate that voice conversion can be used as a data augmentation technique to improve ASR performance, even on LibriSpeech, which contains 2,456 speakers. For ASR augmentation, it is necessary that the VC model be robust to a wide range of input speech. This motivates the use of a non-autoregressive, non-parallel VC model, and the use of a pretrained ASR encoder within the VC model. This work suggests that despite including many speakers, speaker diversity may remain a limitation to ASR quality. Finally, interrogation of our VC performance has provided useful metrics for objective evaluation of VC quality.  ( 2 min )

We provide a differentially private algorithm for producing synthetic data simultaneously useful for multiple tasks: marginal queries and multitask machine learning (ML). A key innovation in our algorithm is the ability to directly handle numerical features, in contrast to a number of related prior approaches which require numerical features to be first converted into {high cardinality} categorical features via {a binning strategy}. Higher binning granularity is required for better accuracy, but this negatively impacts scalability. Eliminating the need for binning allows us to produce synthetic data preserving large numbers of statistical queries such as marginals on numerical features, and class conditional linear threshold queries. Preserving the latter means that the fraction of points of each class label above a particular half-space is roughly the same in both the real and synthetic data. This is the property that is needed to train a linear classifier in a multitask setting. Our algorithm also allows us to produce high quality synthetic data for mixed marginal queries, that combine both categorical and numerical features. Our method consistently runs 2-5x faster than the best comparable techniques, and provides significant accuracy improvements in both marginal queries and linear prediction tasks for mixed-type datasets.  ( 3 min )

Humans are able to learn to recognize new objects even from a few examples. In contrast, training deep-learning-based object detectors requires huge amounts of annotated data. To avoid the need to acquire and annotate these huge amounts of data, few-shot object detection aims to learn from few object instances of new categories in the target domain. In this survey, we provide an overview of the state of the art in few-shot object detection. We categorize approaches according to their training scheme and architectural layout. For each type of approaches, we describe the general realization as well as concepts to improve the performance on novel categories. Whenever appropriate, we give short takeaways regarding these concepts in order to highlight the best ideas. Eventually, we introduce commonly used datasets and their evaluation protocols and analyze reported benchmark results. As a result, we emphasize common challenges in evaluation and identify the most promising current trends in this emerging field of few-shot object detection.  ( 2 min )

Multiple-objective optimization (MOO) aims to simultaneously optimize multiple conflicting objectives and has found important applications in machine learning, such as minimizing classification loss and discrepancy in treating different populations for fairness. At optimality, further optimizing one objective will necessarily harm at least another objective, and decision-makers need to comprehensively explore multiple optima (called Pareto front) to pinpoint one final solution. We address the efficiency of finding the Pareto front. First, finding the front from scratch using stochastic multi-gradient descent (SMGD) is expensive with large neural networks and datasets. We propose to explore the Pareto front as a manifold from a few initial optima, based on a predictor-corrector method. Second, for each exploration step, the predictor solves a large-scale linear system that scales quadratically in the number of model parameters and requires one backpropagation to evaluate a second-order Hessian-vector product per iteration of the solver. We propose a Gauss-Newton approximation that only scales linearly, and that requires only first-order inner-product per iteration. This also allows for a choice between the MINRES and conjugate gradient methods when approximately solving the linear system. The innovations make predictor-corrector possible for large networks. Experiments on multi-objective (fairness and accuracy) misinformation detection tasks show that 1) the predictor-corrector method can find Pareto fronts better than or similar to SMGD with less time; and 2) the proposed first-order method does not harm the quality of the Pareto front identified by the second-order method, while further reduce running time.  ( 3 min )

By imitating biological microswimmers, microrobots can be designed to accomplish targeted delivery of cargos and biomedical manipulations at microscale. However, it is still a great challenge to enable microrobots to maneuver in a complex environment. Machine learning algorithms offer a tool to boost mobility and flexibility of a synthetic microswimmer, hence could help us design truly smart microrobots. In this work, we investigate how a model of sea urchin sperm cell can self-learn chemotactic motion in a chemoattractant concentration field. We employ an artificial neural network to act as a decision-making agent and facilitate the sperm cell to discover efficient maneuver strategies through a deep reinforcement learning (DRL) algorithm. Our results show that chemotactic behaviours, very similar to the realistic ones, can be achieved by the DRL utilizing only limited environmental information. In most cases, the DRL algorithm discovers more efficient strategies than the human-devised one. Furthermore, the DRL can even utilize an external disturbance to facilitate the chemotactic motion if the extra flow information is also taken into account by the artificial neural network. Our results provide insights to the chemotactic process of sea urchin sperm cells and also prepare guidance for the intelligent maneuver of microrobots.  ( 3 min )

We study differentially private (DP) stochastic optimization (SO) with data containing outliers and loss functions that are not Lipschitz continuous. To date, the vast majority of work on DP SO assumes that the loss is Lipschitz (i.e. stochastic gradients are uniformly bounded), and their error bounds scale with the Lipschitz parameter of the loss. While this assumption is convenient, it is often unrealistic: in many practical problems where privacy is required, data may contain outliers or be unbounded, causing some stochastic gradients to have large norm. In such cases, the Lipschitz parameter may be prohibitively large, leading to vacuous excess risk bounds. Thus, building on a recent line of work [WXDX20, KLZ22], we make the weaker assumption that stochastic gradients have bounded $k$-th moments for some $k \geq 2$. Compared with works on DP Lipschitz SO, our excess risk scales with the $k$-th moment bound instead of the Lipschitz parameter of the loss, allowing for significantly faster rates in the presence of outliers. For convex and strongly convex loss functions, we provide the first asymptotically optimal excess risk bounds (up to a logarithmic factor). Moreover, in contrast to the prior works [WXDX20, KLZ22], our bounds do not require the loss function to be differentiable/smooth. We also devise an accelerated algorithm that runs in linear time and yields improved (compared to prior works) and nearly optimal excess risk for smooth losses. Additionally, our work is the first to address non-convex non-Lipschitz loss functions satisfying the Proximal-PL inequality; this covers some classes of neural nets, among other practical models. Our Proximal-PL algorithm has nearly optimal excess risk that almost matches the strongly convex lower bound. Lastly, we provide shuffle DP variations of our algorithms, which do not require a trusted curator (e.g. for distributed learning).  ( 3 min )

Learning concise data representations without supervisory signals is a fundamental challenge in machine learning. A prominent approach to this goal is likelihood-based models such as variational autoencoders (VAE) to learn latent representations based on a meta-prior, which is a general premise assumed beneficial for downstream tasks (e.g., disentanglement). However, such approaches often deviate from the original likelihood architecture to apply the introduced meta-prior, causing undesirable changes in their training. In this paper, we propose a novel representation learning method, Gromov-Wasserstein Autoencoders (GWAE), which directly matches the latent and data distributions. Instead of a likelihood-based objective, GWAE models have a trainable prior optimized by minimizing the Gromov-Wasserstein (GW) metric. The GW metric measures the distance structure-oriented discrepancy between distributions supported on incomparable spaces, e.g., with different dimensionalities. By restricting the family of the trainable prior, we can introduce meta-priors to control latent representations for downstream tasks. The empirical comparison with the existing VAE-based methods shows that GWAE models can learn representations based on meta-priors by changing the prior family without further modifying the GW objective.

In this letter, we address blockage detection and precoder design for multiple-input multiple-output (MIMO) links, without communication overhead required. Blockage detection is achieved by classifying light detection and ranging (LIDAR) data through a physics-based graph neural network (GNN). For precoder design, a preliminary channel estimate is obtained by running ray tracing on a 3D surface obtained from LIDAR data. This estimate is successively refined and the precoder is designed accordingly. Numerical simulations show that blockage detection is successful with 95% accuracy. Our digital precoding achieves 90% of the capacity and analog precoding outperforms previous works exploiting LIDAR for precoder design.  ( 2 min )

Abstraction has been widely studied as a way to improve the efficiency and generalization of reinforcement learning algorithms. In this paper, we study abstraction in the continuous-control setting. We extend the definition of MDP homomorphisms to encompass continuous actions in continuous state spaces. We derive a policy gradient theorem on the abstract MDP, which allows us to leverage approximate symmetries of the environment for policy optimization. Based on this theorem, we propose an actor-critic algorithm that is able to learn the policy and the MDP homomorphism map simultaneously, using the lax bisimulation metric. We demonstrate the effectiveness of our method on benchmark tasks in the DeepMind Control Suite. Our method's ability to utilize MDP homomorphisms for representation learning leads to improved performance when learning from pixel observations.  ( 2 min )

Neural networks are prone to be biased towards spurious correlations between classes and latent attributes exhibited in a major portion of training data, which ruins their generalization capability. This paper proposes a new method for training debiased classifiers with no spurious attribute label. The key idea of the method is to employ a committee of classifiers as an auxiliary module that identifies bias-conflicting data, i.e., data without spurious correlations, and assigns large weights to them when training the main classifier. The committee is learned as a bootstrapped ensemble so that a majority of its classifiers are biased as well as being diverse, and intentionally fail to predict classes of bias-conflicting data accordingly. The consensus within the committee on prediction difficulty thus provides a reliable cue for identifying and weighting bias-conflicting data. Moreover, the committee is also trained with knowledge transferred from the main classifier so that it gradually becomes debiased along with the main classifier and emphasizes more difficult data as training progresses. On five real-world datasets, our method outperforms existing methods using no spurious attribute label like ours and even surpasses those relying on bias labels occasionally.  ( 3 min )

Currently, pre-trained models can be considered the default choice for a wide range of NLP tasks. Despite their SoTA results, there is practical evidence that these models may require a different number of computing layers for different input sequences, since evaluating all layers leads to overconfidence in wrong predictions (namely overthinking). This problem can potentially be solved by implementing adaptive computation time approaches, which were first designed to improve inference speed. Recently proposed PonderNet may be a promising solution for performing an early exit by treating the exit layer's index as a latent variable. However, the originally proposed exit criterion, relying on sampling from trained posterior distribution on the probability of exiting from the $i$-th layer, introduces major variance in exit layer indices, significantly reducing the resulting model's performance. In this paper, we propose improving PonderNet with a novel deterministic Q-exit criterion and a revisited model architecture. We adapted the proposed mechanism to ALBERT and RoBERTa and compared it with recent methods for performing an early exit. We observed that the proposed changes can be considered significant improvements on the original PonderNet architecture and outperform PABEE on a wide range of GLUE tasks. In addition, we also performed an in-depth ablation study of the proposed architecture to further understand Lambda layers and their performance.  ( 3 min )

Generative models (e.g., GANs and diffusion models) learn the underlying data distribution in an unsupervised manner. However, many applications of interest require sampling from a specific region of the generative model's output space or evenly over a range of characteristics. To allow efficient sampling in these scenarios, we propose Generative Visual Prompt (PromptGen), a framework for distributional control over pre-trained generative models by incorporating knowledge of arbitrary off-the-shelf models. PromptGen defines control as an energy-based model (EBM) and samples images in a feed-forward manner by approximating the EBM with invertible neural networks, avoiding optimization at inference. We demonstrate how PromptGen can control several generative models (e.g., StyleGAN2, StyleNeRF, diffusion autoencoder, and NVAE) using various off-the-shelf models: (1) with the CLIP model, PromptGen can sample images guided by text, (2) with image classifiers, PromptGen can de-bias generative models across a set of attributes, and (3) with inverse graphics models, PromptGen can sample images of the same identity in different poses. (4) Finally, PromptGen reveals that the CLIP model shows "reporting bias" when used as control, and PromptGen can further de-bias this controlled distribution in an iterative manner. Our code is available at https://github.com/ChenWu98/Generative-Visual-Prompt.

Mean-Field Control (MFC) has recently been proven to be a scalable tool to approximately solve large-scale multi-agent reinforcement learning (MARL) problems. However, these studies are typically limited to unconstrained cumulative reward maximization framework. In this paper, we show that one can use the MFC approach to approximate the MARL problem even in the presence of constraints. Specifically, we prove that, an $N$-agent constrained MARL problem, with state, and action spaces of each individual agents being of sizes $|\mathcal{X}|$, and $|\mathcal{U}|$ respectively, can be approximated by an associated constrained MFC problem with an error, $e\triangleq \mathcal{O}\left([\sqrt{|\mathcal{X}|}+\sqrt{|\mathcal{U}|}]/\sqrt{N}\right)$. In a special case where the reward, cost, and state transition functions are independent of the action distribution of the population, we prove that the error can be improved to $e=\mathcal{O}(\sqrt{|\mathcal{X}|}/\sqrt{N})$. Also, we provide a Natural Policy Gradient based algorithm and prove that it can solve the constrained MARL problem within an error of $\mathcal{O}(e)$ with a sample complexity of $\mathcal{O}(e^{-6})$.

Given a discriminating neural network, the problem of fairness improvement is to systematically reduce discrimination without significantly scarifies its performance (i.e., accuracy). Multiple categories of fairness improving methods have been proposed for neural networks, including pre-processing, in-processing and post-processing. Our empirical study however shows that these methods are not always effective (e.g., they may improve fairness by paying the price of huge accuracy drop) or even not helpful (e.g., they may even worsen both fairness and accuracy). In this work, we propose an approach which adaptively chooses the fairness improving method based on causality analysis. That is, we choose the method based on how the neurons and attributes responsible for unfairness are distributed among the input attributes and the hidden neurons. Our experimental evaluation shows that our approach is effective (i.e., always identify the best fairness improving method) and efficient (i.e., with an average time overhead of 5 minutes).

Contrastive learning has recently shown immense potential in unsupervised visual representation learning. Existing studies in this track mainly focus on intra-image invariance learning. The learning typically uses rich intra-image transformations to construct positive pairs and then maximizes agreement using a contrastive loss. The merits of inter-image invariance, conversely, remain much less explored. One major obstacle to exploit inter-image invariance is that it is unclear how to reliably construct inter-image positive pairs, and further derive effective supervision from them since no pair annotations are available. In this work, we present a comprehensive empirical study to better understand the role of inter-image invariance learning from three main constituting components: pseudo-label maintenance, sampling strategy, and decision boundary design. To facilitate the study, we introduce a unified and generic framework that supports the integration of unsupervised intra- and inter-image invariance learning. Through carefully-designed comparisons and analysis, multiple valuable observations are revealed: 1) online labels converge faster and perform better than offline labels; 2) semi-hard negative samples are more reliable and unbiased than hard negative samples; 3) a less stringent decision boundary is more favorable for inter-image invariance learning. With all the obtained recipes, our final model, namely InterCLR, shows consistent improvements over state-of-the-art intra-image invariance learning methods on multiple standard benchmarks. We hope this work will provide useful experience for devising effective unsupervised inter-image invariance learning. Code: https://github.com/open-mmlab/mmselfsup.  ( 3 min )

Recently vision transformers have been shown to be competitive with convolution-based methods (CNNs) broadly across multiple vision tasks. The less restrictive inductive bias of transformers endows greater representational capacity in comparison with CNNs. However, in the image classification setting this flexibility comes with a trade-off with respect to sample efficiency, where transformers require ImageNet-scale training. This notion has carried over to video where transformers have not yet been explored for video classification in the low-labeled or semi-supervised settings. Our work empirically explores the low data regime for video classification and discovers that, surprisingly, transformers perform extremely well in the low-labeled video setting compared to CNNs. We specifically evaluate video vision transformers across two contrasting video datasets (Kinetics-400 and SomethingSomething-V2) and perform thorough analysis and ablation studies to explain this observation using the predominant features of video transformer architectures. We even show that using just the labeled data, transformers significantly outperform complex semi-supervised CNN methods that leverage large-scale unlabeled data as well. Our experiments inform our recommendation that semi-supervised learning video work should consider the use of video transformers in the future.  ( 2 min )

The brains of all bilaterally symmetric animals on Earth are are divided into left and right hemispheres. The anatomy and functionality of the hemispheres have a large degree of overlap, but they specialize to possess different attributes. The left hemisphere is believed to specialize in specificity and routine, the right in generalities and novelty. In this study, we propose an artificial neural network that imitates that bilateral architecture using two convolutional neural networks with different training objectives and test it on an image classification task. The bilateral architecture outperforms architectures of similar representational capacity that don't exploit differential specialization. It demonstrates the efficacy of bilateralism and constitutes a new principle that could be incorporated into other computational neuroscientific models and used as an inductive bias when designing new ML systems. An analysis of the model can help us to understand the human brain.  ( 2 min )

High-resolution representations are important for vision-based robotic grasping problems. Existing works generally encode the input images into low-resolution representations via sub-networks and then recover high-resolution representations. This will lose spatial information, and errors introduced by the decoder will be more serious when multiple types of objects are considered or objects are far away from the camera. To address these issues, we revisit the design paradigm of CNN for robotic perception tasks. We demonstrate that using parallel branches as opposed to serial stacked convolutional layers will be a more powerful design for robotic visual grasping tasks. In particular, guidelines of neural network design are provided for robotic perception tasks, e.g., high-resolution representation and lightweight design, which respond to the challenges in different manipulation scenarios. We then develop a novel grasping visual architecture referred to as HRG-Net, a parallel-branch structure that always maintains a high-resolution representation and repeatedly exchanges information across resolutions. Extensive experiments validate that these two designs can effectively enhance the accuracy of visual-based grasping and accelerate network training. We show a series of comparative experiments in real physical environments at Youtube: https://youtu.be/Jhlsp-xzHFY.  ( 2 min )

The use of rehabilitation robotics in clinical applications gains increasing importance, due to therapeutic benefits and the ability to alleviate labor-intensive works. However, their practical utility is dependent on the deployment of appropriate control algorithms, which adapt the level of task-assistance according to each individual patient's need. Generally, the required personalization is achieved through manual tuning by clinicians, which is cumbersome and error-prone. In this work we propose a novel online learning control architecture, which is able to personalize the control force at run time to each individual user. To this end, we deploy Gaussian process-based online learning with previously unseen prediction and update rates. Finally, we evaluate our method in an experimental user study, where the learning controller is shown to provide personalized control, while also obtaining safe interaction forces.  ( 2 min )

Spring-based actuators in legged locomotion provide energy-efficiency and improved performance, but increase the difficulty of controller design. Whereas previous works have focused on extensive modeling and simulation to find optimal controllers for such systems, we propose to learn model-free controllers directly on the real robot. In our approach, gaits are first synthesized by central pattern generators (CPGs), whose parameters are optimized to quickly obtain an open-loop controller that achieves efficient locomotion. Then, to make that controller more robust and further improve the performance, we use reinforcement learning to close the loop, to learn corrective actions on top of the CPGs. We evaluate the proposed approach in DLR's elastic quadruped bert. Our results in learning trotting and pronking gaits show that exploitation of the spring actuator dynamics emerges naturally from optimizing for dynamic motions, yielding high-performing locomotion despite being model-free. The whole process takes no more than 1.5 hours on the real robot and results in natural-looking gaits.  ( 2 min )

Vision-based navigation requires processing complex information to make task-orientated decisions. Applications include autonomous robots, self-driving cars, and assistive vision for humans. One of the key elements in the process is the extraction and selection of relevant features in pixel space upon which to base action choices, for which Machine Learning techniques are well suited. However, Deep Reinforcement Learning agents trained in simulation often exhibit unsatisfactory results when deployed in the real-world due to perceptual differences known as the $\textit{reality gap}$. An approach that is yet to be explored to bridge this gap is self-attention. In this paper we (1) perform a systematic exploration of the hyperparameter space for self-attention based navigation of 3D environments and qualitatively appraise behaviour observed from different hyperparameter sets, including their ability to generalise; (2) present strategies to improve the agents' generalisation abilities and navigation behaviour; and (3) show how models trained in simulation are capable of processing real world images meaningfully in real time. To our knowledge, this is the first demonstration of a self-attention based agent successfully trained in navigating a 3D action space, using less than 4000 parameters.  ( 2 min )

This paper describes an approach for fitting an immersed submanifold of a finite-dimensional Euclidean space to random samples. The reconstruction mapping from the ambient space to the desired submanifold is implemented as a composition of an encoder that maps each point to a tuple of (positive or negative) times and a decoder given by a composition of flows along finitely many vector fields starting from a fixed initial point. The encoder supplies the times for the flows. The encoder-decoder map is obtained by empirical risk minimization, and a high-probability bound is given on the excess risk relative to the minimum expected reconstruction error over a given class of encoder-decoder maps. The proposed approach makes fundamental use of Sussmann's orbit theorem, which guarantees that the image of the reconstruction map is indeed contained in an immersed submanifold.  ( 2 min )

Dimensionality reduction techniques aim at representing high-dimensional data in low-dimensional spaces to extract hidden and useful information or facilitate visual understanding and interpretation of the data. However, few of them take into consideration the potential cluster information contained implicitly in the high-dimensional data. In this paper, we propose LaptSNE, a new graph-layout nonlinear dimensionality reduction method based on t-SNE, one of the best techniques for visualizing high-dimensional data as 2D scatter plots. Specifically, LaptSNE leverages the eigenvalue information of the graph Laplacian to shrink the potential clusters in the low-dimensional embedding when learning to preserve the local and global structure from high-dimensional space to low-dimensional space. It is nontrivial to solve the proposed model because the eigenvalues of normalized symmetric Laplacian are functions of the decision variable. We provide a majorization-minimization algorithm with convergence guarantee to solve the optimization problem of LaptSNE and show how to calculate the gradient analytically, which may be of broad interest when considering optimization with Laplacian-composited objective. We evaluate our method by a formal comparison with state-of-the-art methods on seven benchmark datasets, both visually and via established quantitative measurements. The results demonstrate the superiority of our method over baselines such as t-SNE and UMAP. We also provide out-of-sample extension, large-scale extension and mini-batch extension for our LaptSNE to facilitate dimensionality reduction in various scenarios.  ( 3 min )

Leveraging sparse networks to connect successive layers in deep neural networks has recently been shown to provide benefits to large scale state-of-the-art models. However, network connectivity also plays a significant role on the learning curves of shallow networks, such as the classic Restricted Boltzmann Machines (RBM). A fundamental problem is efficiently finding connectivity patterns that improve the learning curve. Recent principled approaches explicitly include network connections as parameters that must be optimized in the model, but often rely on continuous functions to represent connections and on explicit penalization. This work presents a method to find optimal connectivity patterns for RBMs based on the idea of network gradients: computing the gradient of every possible connection, given a specific connection pattern, and using the gradient to drive a continuous connection strength parameter that in turn is used to determine the connection pattern. Thus, learning RBM parameters and learning network connections is truly jointly performed, albeit with different learning rates, and without changes to the objective function. The method is applied to the MNIST data set showing that better RBM models are found for the benchmark tasks of sample generation and input classification.  ( 2 min )

Transition metal chromophores with earth-abundant transition metals are an important design target for their applications in lighting and non-toxic bioimaging, but their design is challenged by the scarcity of complexes that simultaneously have optimal target absorption energies in the visible region as well as well-defined ground states. Machine learning (ML) accelerated discovery could overcome such challenges by enabling screening of a larger space, but is limited by the fidelity of the data used in ML model training, which is typically from a single approximate density functional. To address this limitation, we search for consensus in predictions among 23 density functional approximations across multiple rungs of Jacobs ladder. To accelerate the discovery of complexes with absorption energies in the visible region while minimizing MR character, we use 2D efficient global optimization to sample candidate low-spin chromophores from multi-million complex spaces. Despite the scarcity (i.e., approx. 0.01\%) of potential chromophores in this large chemical space, we identify candidates with high likelihood (i.e., > 10\%) of computational validation as the ML models improve during active learning, representing a 1,000-fold acceleration in discovery. Absorption spectra of promising chromophores from time-dependent density functional theory verify that 2/3 of candidates have the desired excited state properties. The observation that constituent ligands from our leads have demonstrated interesting optical properties in the literature exemplifies the effectiveness of our construction of a realistic design space and active learning approach.  ( 3 min )

It is now well understood that machine learning models, trained on data without due care, often exhibit unfair and discriminatory behavior against certain populations. Traditional algorithmic fairness research has mainly focused on supervised learning tasks, particularly classification. While fairness in unsupervised learning has received some attention, the literature has primarily addressed fair representation learning of continuous embeddings. In this paper, we conversely focus on unsupervised learning using probabilistic graphical models with discrete latent variables. We develop a fair stochastic variational inference technique for the discrete latent variables, which is accomplished by including a fairness penalty on the variational distribution that aims to respect the principles of intersectionality, a critical lens on fairness from the legal, social science, and humanities literature, and then optimizing the variational parameters under this penalty. We first show the utility of our method in improving equity and fairness for clustering using na\"ive Bayes and Gaussian mixture models on benchmark datasets. To demonstrate the generality of our approach and its potential for real-world impact, we then develop a special-purpose graphical model for criminal justice risk assessments, and use our fairness approach to prevent the inferences from encoding unfair societal biases.  ( 2 min )

As machine learning becomes prevalent, mitigating any unfairness present in the training data becomes critical. Among the various notions of fairness, this paper focuses on the well-known individual fairness, which states that similar individuals should be treated similarly. While individual fairness can be improved when training a model (in-processing), we contend that fixing the data before model training (pre-processing) is a more fundamental solution. In particular, we show that label flipping is an effective pre-processing technique for improving individual fairness. Our system iFlipper solves the optimization problem of minimally flipping labels given a limit to the individual fairness violations, where a violation occurs when two similar examples in the training data have different labels. We first prove that the problem is NP-hard. We then propose an approximate linear programming algorithm and provide theoretical guarantees on how close its result is to the optimal solution in terms of the number of label flips. We also propose techniques for making the linear programming solution more optimal without exceeding the violations limit. Experiments on real datasets show that iFlipper significantly outperforms other pre-processing baselines in terms of individual fairness and accuracy on unseen test sets. In addition, iFlipper can be combined with in-processing techniques for even better results.  ( 2 min )

Markov Chain Monte Carlo methods for sampling from complex distributions and estimating normalization constants often simulate samples from a sequence of intermediate distributions along an annealing path, which bridges between a tractable initial distribution and a target density of interest. Prior work has constructed annealing paths using quasi-arithmetic means, and interpreted the resulting intermediate densities as minimizing an expected divergence to the endpoints. We provide a comprehensive analysis of this 'centroid' property using Bregman divergences under a monotonic embedding of the density function, thereby associating common divergences such as Amari's and Renyi's ${\alpha}$-divergences, ${(\alpha,\beta)}$-divergences, and the Jensen-Shannon divergence with intermediate densities along an annealing path. Our analysis highlights the interplay between parametric families, quasi-arithmetic means, and divergence functions using the rho-tau Bregman divergence framework of Zhang 2004;2013.

Importance sampling (IS) is a popular technique in off-policy evaluation, which re-weights the return of trajectories in the replay buffer to boost sample efficiency. However, training with IS can be unstable and previous attempts to address this issue mainly focus on analyzing the variance of IS. In this paper, we reveal that the instability is also related to a new notion of Reuse Bias of IS -- the bias in off-policy evaluation caused by the reuse of the replay buffer for evaluation and optimization. We theoretically show that the off-policy evaluation and optimization of the current policy with the data from the replay buffer result in an overestimation of the objective, which may cause an erroneous gradient update and degenerate the performance. We further provide a high-probability upper bound of the Reuse Bias, and show that controlling one term of the upper bound can control the Reuse Bias by introducing the concept of stability for off-policy algorithms. Based on these analyses, we finally present a novel Bias-Regularized Importance Sampling (BIRIS) framework along with practical algorithms, which can alleviate the negative impact of the Reuse Bias. Experimental results show that our BIRIS-based methods can significantly improve the sample efficiency on a series of continuous control tasks in MuJoCo.

The rise of social media platforms provides an unbounded, infinitely rich source of aggregate knowledge of the world around us, both historic and real-time, from a human perspective. The greatest challenge we face is how to process and understand this raw and unstructured data, go beyond individual observations and see the "big picture"--the domain of Situation Awareness. We provide an extensive survey of Artificial Intelligence research, focusing on microblog social media data with applications to Situation Awareness, that gives the seminal work and state-of-the-art approaches across six thematic areas: Crime, Disasters, Finance, Physical Environment, Politics, and Health and Population. We provide a novel, unified methodological perspective, identify key results and challenges, and present ongoing research directions.

In decentralized optimization environments, each agent $i$ in a network of $n$ nodes has its own private function $f_i$, and nodes communicate with their neighbors to cooperatively minimize the aggregate objective $\sum_{i=1}^n f_i$. In this setting, synchronizing the nodes' updates incurs significant communication overhead and computational costs, so much of the recent literature has focused on the analysis and design of asynchronous optimization algorithms, where agents activate and communicate at arbitrary times without needing a global synchronization enforcer. However, most works assume that when a node activates, it selects the neighbor to contact based on a fixed probability (e.g., uniformly at random), a choice that ignores the optimization landscape at the moment of activation. Instead, in this work we introduce an optimization-aware selection rule that chooses the neighbor providing the highest dual cost improvement (a quantity related to a dualization of the problem based on consensus). This scheme is related to the coordinate descent (CD) method with the Gauss-Southwell (GS) rule for coordinate updates; in our setting however, only a subset of coordinates is accessible at each iteration (because each node can communicate only with its neighbors), so the existing literature on GS methods does not apply. To overcome this difficulty, we develop a new analytical framework for smooth and strongly convex $f_i$ that covers the class of set-wise CD algorithms -- a class that directly applies to decentralized scenarios, but is not limited to them -- and we show that the proposed set-wise GS rule achieves a speedup factor of up to the maximum degree in the network (which is in the order of $\Theta(n)$ for highly connected graphs). The speedup predicted by our analysis is validated in numerical experiments with synthetic data.

Determining an appropriate number of attention heads on one hand and the number of transformer-encoders, on the other hand, is an important choice for Computer Vision (CV) tasks using the Transformer architecture. Computing experiments confirmed the expectation that the total number of parameters has to satisfy the condition of overdetermination (i.e., number of constraints significantly exceeding the number of parameters). Then, good generalization performance can be expected. This sets the boundaries within which the number of heads and the number of transformers can be chosen. If the role of context in images to be classified can be assumed to be small, it is favorable to use multiple transformers with a low number of heads (such as one or two). In classifying objects whose class may heavily depend on the context within the image (i.e., the meaning of a patch being dependent on other patches), the number of heads is equally important as that of transformers.

The notion of omnipredictors (Gopalan, Kalai, Reingold, Sharan and Wieder ITCS 2021), suggested a new paradigm for loss minimization. Rather than learning a predictor based on a known loss function, omnipredictors can easily be post-processed to minimize any one of a rich family of loss functions compared with the loss of a class $C$. It has been shown that such omnipredictors exist and are implied (for all convex and Lipschitz loss functions) by the notion of multicalibration from the algorithmic fairness literature. Nevertheless, it is often the case that the action selected must obey some additional constraints (such as capacity or parity constraints). In itself, the original notion of omnipredictors does not apply in this well-motivated and heavily studied the context of constrained loss minimization. In this paper, we introduce omnipredictors for constrained optimization and study their complexity and implications. The notion that we introduce allows the learner to be unaware of the loss function that will be later assigned as well as the constraints that will be later imposed, as long as the subpopulations that are used to define these constraints are known. The paper shows how to obtain omnipredictors for constrained optimization problems, relying on appropriate variants of multicalibration. For some interesting constraints and general loss functions and for general constraints and some interesting loss functions, we show how omnipredictors are implied by a variant of multicalibration that is similar in complexity to standard multicalibration. We demonstrate that in the general case, standard multicalibration is insufficient and show that omnipredictors are implied by multicalibration with respect to a class containing all the level sets of hypotheses in $C$. We also investigate the implications when the constraints are group fairness notions.

The prototypical network is a prototype classifier based on meta-learning and is widely used for few-shot learning because it classifies unseen examples by constructing class-specific prototypes without adjusting hyper-parameters during meta-testing. Interestingly, recent research has attracted a lot of attention, showing that training a new linear classifier, which does not use a meta-learning algorithm, performs comparably with the prototypical network. However, the training of a new linear classifier requires the retraining of the classifier every time a new class appears. In this paper, we analyze how a prototype classifier works equally well without training a new linear classifier or meta-learning. We experimentally find that directly using the feature vectors, which is extracted by using standard pre-trained models to construct a prototype classifier in meta-testing, does not perform as well as the prototypical network and training new linear classifiers on the feature vectors of pre-trained models. Thus, we derive a novel generalization bound for a prototypical classifier and show that the transformation of a feature vector can improve the performance of prototype classifiers. We experimentally investigate several normalization methods for minimizing the derived bound and find that the same performance can be obtained by using the L2 normalization and minimizing the ratio of the within-class variance to the between-class variance without training a new classifier or meta-learning.

This paper provides a theoretical study of deep neural function approximation in reinforcement learning (RL) with the $\epsilon$-greedy exploration under the online setting. This problem setting is motivated by the successful deep Q-networks (DQN) framework that falls in this regime. In this work, we provide an initial attempt on theoretical understanding deep RL from the perspective of function class and neural networks architectures (e.g., width and depth) beyond the "linear" regime. To be specific, we focus on the value based algorithm with the $\epsilon$-greedy exploration via deep (and two-layer) neural networks endowed by Besov (and Barron) function spaces, respectively, which aims at approximating an $\alpha$-smooth Q-function in a $d$-dimensional feature space. We prove that, with $T$ episodes, scaling the width $m = \widetilde{\mathcal{O}}(T^{\frac{d}{2\alpha + d}})$ and the depth $L=\mathcal{O}(\log T)$ of the neural network for deep RL is sufficient for learning with sublinear regret in Besov spaces. Moreover, for a two layer neural network endowed by the Barron space, scaling the width $\Omega(\sqrt{T})$ is sufficient. To achieve this, the key issue in our analysis is how to estimate the temporal difference error under deep neural function approximation as the $\epsilon$-greedy exploration is not enough to ensure "optimism". Our analysis reformulates the temporal difference error in an $L^2(\mathrm{d}\mu)$-integrable space over a certain averaged measure $\mu$, and transforms it to a generalization problem under the non-iid setting. This might have its own interest in RL theory for better understanding $\epsilon$-greedy exploration in deep RL.

In this paper we present a hybrid neural network augmented physics-based modeling (APBM) framework for Bayesian nonlinear latent space estimation. The proposed APBM strategy allows for model adaptation when new operation conditions come into play or the physics-based model is insufficient (or incomplete) to properly describe the latent phenomenon. One advantage of the APBMs and our estimation procedure is the capability of maintaining the physical interpretability of estimated states. Furthermore, we propose a constraint filtering approach to control the neural network contributions to the overall model. We also exploit assumed density filtering techniques and cubature integration rules to present a flexible estimation strategy that can easily deal with nonlinear models and high-dimensional latent spaces. Finally, we demonstrate the efficacy of our methodology by leveraging a target tracking scenario with nonlinear and incomplete measurement and acceleration models, respectively.

The Natarajan dimension is a fundamental tool for characterizing multi-class PAC learnability, generalizing the Vapnik-Chervonenkis (VC) dimension from binary to multi-class classification problems. This note establishes upper bounds on Natarajan dimensions for certain function classes, including (i) multi-class decision tree and random forests, and (ii) multi-class neural networks with binary, linear and ReLU activations. These results may be relevant for describing the performance of certain multi-class learning algorithms.

Tactics in StarCraft II are closely related to group behavior of the game agents. In other words, human players in the game often group spatially near agents into a team and control the team to defeat opponents. In this light, clustering the agents in StarCraft II has been studied for various purposes such as the efficient control of the agents in multi-agent reinforcement learning and game analytic tools for the game users. However, these works do not aim to learn and predict dynamics of the clusters, limiting the applications to currently observed game status. In this paper, we present a hybrid AI model that couples unsupervised and self-supervised learning to forecast evolution of the clusters in StarCraft II. We develop an unsupervised Hebbian learning method in a set-to-cluster module to efficiently create a variable number of the clusters, and it also features lower inference time complexity than conventional k-means clustering. For the prediction task, a long short-term memory based prediction module is designed to recursively forecast state vectors generated by the set-to-cluster module. We observe the proposed model successfully predicts complex evolution of the clusters with regard to cluster centroids and their radii.

Consider a set of points sampled independently near a smooth compact submanifold of Euclidean space. We provide mathematically rigorous bounds on the number of sample points required to estimate both the dimension and the tangent spaces of that manifold with high confidence. The algorithm for this estimation is Local PCA, a local version of principal component analysis. Our results accommodate for noisy non-uniform data distribution with the noise that may vary across the manifold, and allow simultaneous estimation at multiple points. Crucially, all of the constants appearing in our bound are explicitly described. The proof uses a matrix concentration inequality to estimate covariance matrices and a Wasserstein distance bound for quantifying nonlinearity of the underlying manifold and non-uniformity of the probability measure.

We propose a new hybrid modelling approach that combines a mechanistic model with a machine-learnt model to predict the limit cycle oscillations of physical systems with a Hopf bifurcation. The mechanistic model is an ordinary differential equation normal-form model capturing the bifurcation structure of the system. A data-driven mapping from this model to the experimental observations is then identified based on experimental data using machine learning techniques. The proposed method is first demonstrated numerically on a Van der Pol oscillator and a three-degree-of-freedom aeroelastic model. It is then applied to model the behaviour of a physical aeroelastic structure exhibiting limit cycle oscillations during wind tunnel tests. The method is shown to be general, data-efficient and to offer good accuracy without any prior knowledge about the system other than its bifurcation structure.

Seismic phase association connects earthquake arrival time measurements to their causative sources. Effective association must determine the number of discrete events, their location and origin times, and it must differentiate real arrivals from measurement artifacts. The advent of deep learning pickers, which provide high rates of picks from closely overlapping small magnitude earthquakes, motivates revisiting the phase association problem and approaching it using the methods of deep learning. We have developed a Graph Neural Network associator that simultaneously predicts both source space-time localization, and discrete source-arrival association likelihoods. The method is applicable to arbitrary geometry, time-varying seismic networks of hundreds of stations, and is robust to high rates of sources and input picks with variable noise and quality. Our Graph Earthquake Neural Interpretation Engine (GENIE) uses one graph to represent the station set and another to represent the spatial source region. GENIE learns relationships from data in this combined representation that enable it to determine robust source and source-arrival associations. We train on synthetic data, and test our method on real data from the Northern California (NC) seismic network using input generated by the PhaseNet deep learning phase picker. We successfully re-detect ~96% of all events M>1 reported by the USGS during 500 random days between 2000$\unicode{x2013}$2022. Over a 100-day continuous interval of processing in 2017$\unicode{x2013}$2018, we detect ~4.2x the number of events reported by the USGS. Our new events have small magnitude estimates below the magnitude of completeness of the USGS catalog, and are located close to the active faults and quarries in the region. Our results demonstrate that GENIE can effectively solve the association problem under complex seismic monitoring conditions.

Test-time training adapts to a new test distribution on the fly by optimizing a model for each test input using self-supervision. In this paper, we use masked autoencoders for this one-sample learning problem. Empirically, our simple method improves generalization on many visual benchmarks for distribution shifts. Theoretically, we characterize this improvement in terms of the bias-variance trade-off.

De novo molecular design has facilitated the exploration of large chemical space to accelerate drug discovery. Structure-based de novo method can overcome the data scarcity of active ligands by incorporating drug-target interaction into deep generative architectures. However, these strategies are bottlenecked by the small fraction of experimentally determined protein or complex structures. In addition, the cost of molecular generation is computationally expensive due to 3D representations of both molecule and protein. Here, we demonstrate a widely used and fast protein sequence-based reinforcement learning (RL) model for drug discovery. In the generative model, one of the reward components, a binding affinity predictor, is based on 1D protein sequence and molecular SMILES. As a proof of concept, the RL model was utilized to design molecules for four targets. The generated compounds showed bioactivities by the validation of both QSAR and molecular docking with experimental 3D binding pockets. We also found that the performance of generated molecules depends on the selection of data source training for the binding predictor. Furthermore, drug design for a kinase without any experimental structure, CDK20, was studied by our model. With only 1D protein sequence as input, the generated novel compounds showed favorable binding affinity based on the AlphaFold predicted structure.

This study investigates the impact of machine learning models on the generation of counterfactual explanations by conducting a benchmark evaluation over three different types of models: decision-tree (fully transparent, interpretable, white-box model), a random forest (a semi-interpretable, grey-box model), and a neural network (a fully opaque, black-box model). We tested the counterfactual generation process using four algorithms (DiCE, WatcherCF, prototype, and GrowingSpheresCF) in the literature in five different datasets (COMPAS, Adult, German, Diabetes, and Breast Cancer). Our findings indicate that: (1) Different machine learning models have no impact on the generation of counterfactual explanations; (2) Counterfactual algorithms based uniquely on proximity loss functions are not actionable and will not provide meaningful explanations; (3) One cannot have meaningful evaluation results without guaranteeing plausibility in the counterfactual generation process. Algorithms that do not consider plausibility in their internal mechanisms will lead to biased and unreliable conclusions if evaluated with the current state-of-the-art metrics; (4) A qualitative analysis is strongly recommended (together with a quantitative analysis) to ensure a robust analysis of counterfactual explanations and the potential identification of biases.

In domains where sample sizes are limited, efficient learning algorithms are critical. Learning using privileged information (LuPI) offers increased sample efficiency by allowing prediction models access to types of information at training time which is unavailable when the models are used. In recent work, it was shown that for prediction in linear-Gaussian dynamical systems, a LuPI learner with access to intermediate time series data is never worse and often better in expectation than any unbiased classical learner. We provide new insights into this analysis and generalize it to nonlinear prediction tasks in latent dynamical systems, extending theoretical guarantees to the case where the map connecting latent variables and observations is known up to a linear transform. In addition, we propose algorithms based on random features and representation learning for the case when this map is unknown. A suite of empirical results confirm theoretical findings and show the potential of using privileged time-series information in nonlinear prediction.

Multimodal sentiment analysis has become an increasingly popular research area as the demand for multimodal online content is growing. For multimodal sentiment analysis, words can have different meanings depending on the linguistic context and non-verbal information, so it is crucial to understand the meaning of the words accordingly. In addition, the word meanings should be interpreted within the whole utterance context that includes nonverbal information. In this paper, we present a Context-driven Modality Shifting BERT with Contrastive Learning for linguistic, visual, acoustic Representations (CMSBERT-CLR), which incorporates the whole context's non-verbal and verbal information and aligns modalities more effectively through contrastive learning. First, we introduce a Context-driven Modality Shifting (CMS) to incorporate the non-verbal and verbal information within the whole context of the sentence utterance. Then, for improving the alignment of different modalities within a common embedding space, we apply contrastive learning. Furthermore, we use an exponential moving average parameter and label smoothing as optimization strategies, which can make the convergence of the network more stable and increase the flexibility of the alignment. In our experiments, we demonstrate that our approach achieves state-of-the-art results.

The traditional Machine Learning (ML) methodology requires to fragment the development and experimental process into disconnected iterations whose feedback is used to guide design or tuning choices. This methodology has multiple efficiency and scalability disadvantages, such as leading to spend significant resources into the creation of multiple trial models that do not contribute to the final solution.The presented work is based on the intuition that defining ML models as modular and extensible artefacts allows to introduce a novel ML development methodology enabling the integration of multiple design and evaluation iterations into the continuous enrichment of a single unbounded intelligent system. We define a novel method for the generation of dynamic multitask ML models as a sequence of extensions and generalizations. We first analyze the capabilities of the proposed method by using the standard ML empirical evaluation methodology. Finally, we propose a novel continuous development methodology that allows to dynamically extend a pre-existing multitask large-scale ML system while analyzing the properties of the proposed method extensions. This results in the generation of an ML model capable of jointly solving 124 image classification tasks achieving state of the art quality with improved size and compute cost.

Despite the progress in utilizing deep learning to automate chest radiograph interpretation and disease diagnosis tasks, change between sequential Chest X-rays (CXRs) has received limited attention. Monitoring the progression of pathologies that are visualized through chest imaging poses several challenges in anatomical motion estimation and image registration, i.e., spatially aligning the two images and modeling temporal dynamics in change detection. In this work, we propose CheXRelNet, a neural model that can track longitudinal pathology change relations between two CXRs. CheXRelNet incorporates local and global visual features, utilizes inter-image and intra-image anatomical information, and learns dependencies between anatomical region attributes, to accurately predict disease change for a pair of CXRs. Experimental results on the Chest ImaGenome dataset show increased downstream performance compared to baselines. Code is available at https://github.com/PLAN-Lab/ChexRelNet

The evolution of digital technology and the increasing popularity of sports inspired the innovators to take the experience of users with a proclivity towards sports to a whole new different level, by introducing Fantasy Sports Platforms FSPs. The application of Data Science and Analytics is Ubiquitous in the Modern World. Data Science and Analytics open doors to gain a deeper understanding and help in the decision making process. We firmly believed that we could adopt Data Science to predict the winning fantasy cricket team on the FSP, Dream 11. We built a predictive model that predicts the performance of players in a prospective game. We used a combination of Greedy and Knapsack Algorithms to prescribe the combination of 11 players to create a fantasy cricket team that has the most significant statistical odds of finishing as the strongest team thereby giving us a higher chance of winning the pot of bets on the Dream 11 FSP. We used PyCaret Python Library to help us understand and adopt the best Regressor Algorithm for our problem statement to make precise predictions. Further, we used Plotly Python Library to give us visual insights into the team, and players performances by accounting for the statistical, and subjective factors of a prospective game. The interactive plots help us to bolster the recommendations of our predictive model. You either win big, win small, or lose your bet based on the performance of the players selected for your fantasy team in the prospective game, and our model increases the probability of you winning big.

We consider the stochastic gradient descent (SGD) algorithm driven by a general stochastic sequence, including i.i.d noise and random walk on an arbitrary graph, among others; and analyze it in the asymptotic sense. Specifically, we employ the notion of `efficiency ordering', a well-analyzed tool for comparing the performance of Markov Chain Monte Carlo (MCMC) samplers, for SGD algorithms in the form of Loewner ordering of covariance matrices associated with the scaled iterate errors in the long term. Using this ordering, we show that input sequences that are more efficient for MCMC sampling also lead to smaller covariance of the errors for SGD algorithms in the limit. This also suggests that an arbitrarily weighted MSE of SGD iterates in the limit becomes smaller when driven by more efficient chains. Our finding is of particular interest in applications such as decentralized optimization and swarm learning, where SGD is implemented in a random walk fashion on the underlying communication graph for cost issues and/or data privacy. We demonstrate how certain non-Markovian processes, for which typical mixing-time based non-asymptotic bounds are intractable, can outperform their Markovian counterparts in the sense of efficiency ordering for SGD. We show the utility of our method by applying it to gradient descent with shuffling and mini-batch gradient descent, reaffirming key results from existing literature under a unified framework. Empirically, we also observe efficiency ordering for variants of SGD such as accelerated SGD and Adam, open up the possibility of extending our notion of efficiency ordering to a broader family of stochastic optimization algorithms.

We present a systematic study of domain generalization (DG) for tiny neural networks, a problem that is critical to on-device machine learning applications but has been overlooked in the literature where research has been focused on large models only. Tiny neural networks have much fewer parameters and lower complexity, and thus should not be trained the same way as their large counterparts for DG applications. We find that knowledge distillation is a strong candidate for solving the problem: it outperforms state-of-the-art DG methods that were developed using large models with a large margin. Moreover, we observe that the teacher-student performance gap on test data with domain shift is bigger than that on in-distribution data. To improve DG for tiny neural networks without increasing the deployment cost, we propose a simple idea called out-of-distribution knowledge distillation (OKD), which aims to teach the student how the teacher handles (synthetic) out-of-distribution data and is proved to be a promising framework for solving the problem. We also contribute a scalable method of creating DG datasets, called DOmain Shift in COntext (DOSCO), which can be applied to broad data at scale without much human effort. Code and models are released at \url{https://github.com/KaiyangZhou/on-device-dg}.

Neural architecture search (NAS) has demonstrated amazing success in searching for efficient deep neural networks (DNNs) from a given supernet. In parallel, the lottery ticket hypothesis has shown that DNNs contain small subnetworks that can be trained from scratch to achieve a comparable or higher accuracy than original DNNs. As such, it is currently a common practice to develop efficient DNNs via a pipeline of first search and then prune. Nevertheless, doing so often requires a search-train-prune-retrain process and thus prohibitive computational cost. In this paper, we discover for the first time that both efficient DNNs and their lottery subnetworks (i.e., lottery tickets) can be directly identified from a supernet, which we term as SuperTickets, via a two-in-one training scheme with jointly architecture searching and parameter pruning. Moreover, we develop a progressive and unified SuperTickets identification strategy that allows the connectivity of subnetworks to change during supernet training, achieving better accuracy and efficiency trade-offs than conventional sparse training. Finally, we evaluate whether such identified SuperTickets drawn from one task can transfer well to other tasks, validating their potential of handling multiple tasks simultaneously. Extensive experiments and ablation studies on three tasks and four benchmark datasets validate that our proposed SuperTickets achieve boosted accuracy and efficiency trade-offs than both typical NAS and pruning pipelines, regardless of having retraining or not. Codes and pretrained models are available at https://github.com/RICE-EIC/SuperTickets.

In this paper, we propose to adopt the MDE paradigm for the development of Machine Learning (ML)-enabled software systems with a focus on the Internet of Things (IoT) domain. We illustrate how two state-of-the-art open-source modeling tools, namely MontiAnna and ML-Quadrat can be used for this purpose as demonstrated through a case study. The case study illustrates using ML, in particular deep Artificial Neural Networks (ANNs), for automated image recognition of handwritten digits using the MNIST reference dataset, and integrating the machine learning components into an IoT system. Subsequently, we conduct a functional comparison of the two frameworks, setting out an analysis base to include a broad range of design considerations, such as the problem domain, methods for the ML integration into larger systems, and supported ML methods, as well as topics of recent intense interest to the ML community, such as AutoML and MLOps. Accordingly, this paper is focused on elucidating the potential of the MDE approach in the ML domain. This supports the ML engineer in developing the (ML/software) model rather than implementing the code, and additionally enforces reusability and modularity of the design through enabling the out-of-the-box integration of ML functionality as a component of the IoT or cyber-physical systems.

In the future, powerful AI systems may be deployed in high-stakes settings, where a single failure could be catastrophic. One technique for improving AI safety in high-stakes settings is adversarial training, which uses an adversary to generate examples to train on in order to achieve better worst-case performance. In this work, we used a language generation task as a testbed for achieving high reliability through adversarial training. We created a series of adversarial training techniques -- including a tool that assists human adversaries -- to find and eliminate failures in a classifier that filters text completions suggested by a generator. In our simple "avoid injuries" task, we determined that we can set very conservative classifier thresholds without significantly impacting the quality of the filtered outputs. With our chosen thresholds, filtering with our baseline classifier decreases the rate of unsafe completions from about 2.4% to 0.003% on in-distribution data, which is near the limit of our ability to measure. We found that adversarial training significantly increased robustness to the adversarial attacks that we trained on, without affecting in-distribution performance. We hope to see further work in the high-stakes reliability setting, including more powerful tools for enhancing human adversaries and better ways to measure high levels of reliability, until we can confidently rule out the possibility of catastrophic deployment-time failures of powerful models.

The recent rapid growth in mobile data traffic entails a pressing demand for improving the throughput of the underlying wireless communication networks. Network node deployment has been considered as an effective approach for throughput enhancement which, however, often leads to highly non-trivial non-convex optimizations. Although convex approximation based solutions are considered in the literature, their approximation to the actual throughput may be loose and sometimes lead to unsatisfactory performance. With this consideration, in this paper, we propose a novel graph neural network (GNN) method for the network node deployment problem. Specifically, we fit a GNN to the network throughput and use the gradients of this GNN to iteratively update the locations of the network nodes. Besides, we show that an expressive GNN has the capacity to approximate both the function value and the gradients of a multivariate permutation-invariant function, as a theoretic support to the proposed method. To further improve the throughput, we also study a hybrid node deployment method based on this approach. To train the desired GNN, we adopt a policy gradient algorithm to create datasets containing good training samples. Numerical experiments show that the proposed methods produce competitive results compared to the baselines.

Neural networks trained with stochastic gradient descent (SGD) starting from different random initialisations typically find functionally very similar solutions, raising the question of whether there are meaningful differences between different SGD solutions. Entezari et al. recently conjectured that despite different initialisations, the solutions found by SGD lie in the same loss valley after taking into account the permutation invariance of neural networks. Concretely, they hypothesise that any two solutions found by SGD can be permuted such that the linear interpolation between their parameters forms a path without significant increases in loss. Here, we use a simple but powerful algorithm to find such permutations that allows us to obtain direct empirical evidence that the hypothesis is true in fully connected networks. Strikingly, we find that two networks already live in the same loss valley at the time of initialisation and averaging their random, but suitably permuted initialisation performs significantly above chance. In contrast, for convolutional architectures, our evidence suggests that the hypothesis does not hold. Especially in a large learning rate regime, SGD seems to discover diverse modes.

We present a minimax optimal learner for the problem of learning predictors robust to adversarial examples at test-time. Interestingly, we find that this requires new algorithmic ideas and approaches to adversarially robust learning. In particular, we show, in a strong negative sense, the suboptimality of the robust learner proposed by Montasser, Hanneke, and Srebro (2019) and a broader family of learners we identify as local learners. Our results are enabled by adopting a global perspective, specifically, through a key technical contribution: the global one-inclusion graph, which may be of independent interest, that generalizes the classical one-inclusion graph due to Haussler, Littlestone, and Warmuth (1994). Finally, as a byproduct, we identify a dimension characterizing qualitatively and quantitatively what classes of predictors $\mathcal{H}$ are robustly learnable. This resolves an open problem due to Montasser et al. (2019), and closes a (potentially) infinite gap between the established upper and lower bounds on the sample complexity of adversarially robust learning.

This paper investigates the post-hoc calibration of confidence for "exploratory" machine learning classification problems. The difficulty in these problems stems from the continuing desire to push the boundaries of which categories have enough examples to generalize from when curating datasets, and confusion regarding the validity of those categories. We argue that for such problems the "one-versus-all" approach (top-label calibration) must be used rather than the "calibrate-the-full-response-matrix" approach advocated elsewhere in the literature. We introduce and test four new algorithms designed to handle the idiosyncrasies of category-specific confidence estimation. Chief among these methods is the use of kernel density ratios for confidence calibration including a novel, bulletproof algorithm for choosing the bandwidth. We test our claims and explore the limits of calibration on a bioinformatics application (PhANNs) as well as the classic MNIST benchmark. Finally, our analysis argues that post-hoc calibration should always be performed, should be based only on the test dataset, and should be sanity-checked visually.

In recent years, reinforcement learning and its multi-agent analogue have achieved great success in solving various complex control problems. However, multi-agent reinforcement learning remains challenging both in its theoretical analysis and empirical design of algorithms, especially for large swarms of embodied robotic agents where a definitive toolchain remains part of active research. We use emerging state-of-the-art mean-field control techniques in order to convert many-agent swarm control into more classical single-agent control of distributions. This allows profiting from advances in single-agent reinforcement learning at the cost of assuming weak interaction between agents. As a result, the mean-field model is violated by the nature of real systems with embodied, physically colliding agents. Here, we combine collision avoidance and learning of mean-field control into a unified framework for tractably designing intelligent robotic swarm behavior. On the theoretical side, we provide novel approximation guarantees for both general mean-field control in continuous spaces and with collision avoidance. On the practical side, we show that our approach outperforms multi-agent reinforcement learning and allows for decentralized open-loop application while avoiding collisions, both in simulation and real UAV swarms. Overall, we propose a framework for the design of swarm behavior that is both mathematically well-founded and practically useful, enabling the solution of otherwise intractable swarm problems.

Urban downscaling is a link to transfer the knowledge from coarser climate information to city scale assessments. These high-resolution assessments need multiyear climatology of past data and future projections, which are complex and computationally expensive to generate using traditional numerical weather prediction models. The city of Austin, Texas, USA has seen tremendous growth in the past decade. Systematic planning for the future requires the availability of fine resolution city-scale datasets. In this study, we demonstrate a novel approach generating a general purpose operator using deep learning to perform urban downscaling. The algorithm employs an iterative super-resolution convolutional neural network (Iterative SRCNN) over the city of Austin, Texas, USA. We show the development of a high-resolution gridded precipitation product (300 m) from a coarse (10 km) satellite-based product (JAXA GsMAP). High resolution gridded datasets of precipitation offer insights into the spatial distribution of heavy to low precipitation events in the past. The algorithm shows improvement in the mean peak-signal-to-noise-ratio and mutual information to generate high resolution gridded product of size 300 m X 300 m relative to the cubic interpolation baseline. Our results have implications for developing high-resolution gridded-precipitation urban datasets and the future planning of smart cities for other cities and other climatic variables.

We propose Deterministic Sequencing of Exploration and Exploitation (DSEE) algorithm with interleaving exploration and exploitation epochs for model-based RL problems that aim to simultaneously learn the system model, i.e., a Markov decision process (MDP), and the associated optimal policy. During exploration, DSEE explores the environment and updates the estimates for expected reward and transition probabilities. During exploitation, the latest estimates of the expected reward and transition probabilities are used to obtain a robust policy with high probability. We design the lengths of the exploration and exploitation epochs such that the cumulative regret grows as a sub-linear function of time.

Graph neural networks (GNNs) have drawn more and more attention from material scientists and demonstrated a high capacity to establish connections between the structure and properties. However, with only unrelaxed structures provided as input, few GNN models can predict the thermodynamic properties of relaxed configurations with an acceptable level of error. In this work, we develop a multi-task (MT) architecture based on DimeNet++ and mixture density networks to improve the performance of such task. Taking CO adsorption on Cu-based single-atom alloy catalysts as an illustration, we show that our method can reliably estimate CO adsorption energy with a mean absolute error of 0.087 eV from the initial CO adsorption structures without costly first-principles calculations. Further, compared to other state-of-the-art GNN methods, our model exhibits improved generalization ability when predicting catalytic performance of out-of-domain configurations, built with either unseen substrate surfaces or doping species. We show that the proposed MT GNN strategy can facilitate catalyst discovery.

Much of the literature on optimal design of bandit algorithms is based on minimization of expected regret. It is well known that designs that are optimal over certain exponential families can achieve expected regret that grows logarithmically in the number of arm plays, at a rate governed by the Lai-Robbins lower bound. In this paper, we show that when one uses such optimized designs, the regret distribution of the associated algorithms necessarily has a very heavy tail, specifically, that of a truncated Cauchy distribution. Furthermore, for $p>1$, the $p$'th moment of the regret distribution grows much faster than poly-logarithmically, in particular as a power of the total number of arm plays. We show that optimized UCB bandit designs are also fragile in an additional sense, namely when the problem is even slightly mis-specified, the regret can grow much faster than the conventional theory suggests. Our arguments are based on standard change-of-measure ideas, and indicate that the most likely way that regret becomes larger than expected is when the optimal arm returns below-average rewards in the first few arm plays, thereby causing the algorithm to believe that the arm is sub-optimal. To alleviate the fragility issues exposed, we show that UCB algorithms can be modified so as to ensure a desired degree of robustness to mis-specification. In doing so, we also provide a sharp trade-off between the amount of UCB exploration and the tail exponent of the resulting regret distribution.

The increasing energy consumption and carbon footprint of deep learning (DL) due to growing compute requirements has become a cause of concern. In this work, we focus on the carbon footprint of developing DL models for medical image analysis (MIA), where volumetric images of high spatial resolution are handled. In this study, we present and compare the features of four tools from literature to quantify the carbon footprint of DL. Using one of these tools we estimate the carbon footprint of medical image segmentation pipelines. We choose nnU-net as the proxy for a medical image segmentation pipeline and experiment on three common datasets. With our work we hope to inform on the increasing energy costs incurred by MIA. We discuss simple strategies to cut-down the environmental impact that can make model selection and training processes more efficient.

Nowadays self-paced learning (SPL) is an important machine learning paradigm that mimics the cognitive process of humans and animals. The SPL regime involves a self-paced regularizer and a gradually increasing age parameter, which plays a key role in SPL but where to optimally terminate this process is still non-trivial to determine. A natural idea is to compute the solution path w.r.t. age parameter (i.e., age-path). However, current age-path algorithms are either limited to the simplest regularizer, or lack solid theoretical understanding as well as computational efficiency. To address this challenge, we propose a novel \underline{G}eneralized \underline{Ag}e-path \underline{A}lgorithm (GAGA) for SPL with various self-paced regularizers based on ordinary differential equations (ODEs) and sets control, which can learn the entire solution spectrum w.r.t. a range of age parameters. To the best of our knowledge, GAGA is the first exact path-following algorithm tackling the age-path for general self-paced regularizer. Finally the algorithmic steps of classic SVM and Lasso are described in detail. We demonstrate the performance of GAGA on real-world datasets, and find considerable speedup between our algorithm and competing baselines.

The commitment to single-precision floating-point arithmetic is widespread in the deep learning community. To evaluate whether this commitment is justified, the influence of computing precision (single and double precision) on the optimization performance of the Conjugate Gradient (CG) method (a second-order optimization algorithm) and RMSprop (a first-order algorithm) has been investigated. Tests of neural networks with one to five fully connected hidden layers and moderate or strong nonlinearity with up to 4 million network parameters have been optimized for Mean Square Error (MSE). The training tasks have been set up so that their MSE minimum was known to be zero. Computing experiments have disclosed that single-precision can keep up (with superlinear convergence) with double-precision as long as line search finds an improvement. First-order methods such as RMSprop do not benefit from double precision. However, for moderately nonlinear tasks, CG is clearly superior. For strongly nonlinear tasks, both algorithm classes find only solutions fairly poor in terms of mean square error as related to the output variance. CG with double floating-point precision is superior whenever the solutions have the potential to be useful for the application goal.

We study online learning problems in which a decision maker has to take a sequence of decisions subject to $m$ long-term constraints. The goal of the decision maker is to maximize their total reward, while at the same time achieving small cumulative constraints violation across the $T$ rounds. We present the first best-of-both-world type algorithm for this general class of problems, with no-regret guarantees both in the case in which rewards and constraints are selected according to an unknown stochastic model, and in the case in which they are selected at each round by an adversary. Our algorithm is the first to provide guarantees in the adversarial setting with respect to the optimal fixed strategy that satisfies the long-term constraints. In particular, it guarantees a $\rho/(1+\rho)$ fraction of the optimal reward and sublinear regret, where $\rho$ is a feasibility parameter related to the existence of strictly feasible solutions. Our framework employs traditional regret minimizers as black-box components. Therefore, by instantiating it with an appropriate choice of regret minimizers it can handle the full-feedback as well as the bandit-feedback setting. Moreover, it allows the decision maker to seamlessly handle scenarios with non-convex rewards and constraints. We show how our framework can be applied in the context of budget-management mechanisms for repeated auctions in order to guarantee long-term constraints that are not packing (e.g., ROI constraints).

In this work, we propose a novel approach for layerwise representation learning of a trained neural network. In particular, we form a Bregman divergence based on the layer's transfer function and construct an extension of the original Bregman PCA formulation by incorporating a mean vector and normalizing the principal directions with respect to the geometry of the local convex function around the mean. This generalization allows exporting the learned representation as a fixed layer with a non-linearity. As an application to knowledge distillation, we cast the learning problem for the student network as predicting the compression coefficients of the teacher's representations, which are passed as the input to the imported layer. Our empirical findings indicate that our approach is substantially more effective for transferring information between networks than typical teacher-student training using the teacher's penultimate layer representations and soft labels.

Time series classification is an important problem in real world. Due to its non-stationary property that the distribution changes over time, it remains challenging to build models for generalization to unseen distributions. In this paper, we propose to view the time series classification problem from the distribution perspective. We argue that the temporal complexity attributes to the unknown latent distributions within. To this end, we propose DIVERSIFY to learn generalized representations for time series classification. DIVERSIFY takes an iterative process: it first obtains the worst-case distribution scenario via adversarial training, then matches the distributions of the obtained sub-domains. We also present some theoretical insights. We conduct experiments on gesture recognition, speech commands recognition, wearable stress and affect detection, and sensor-based human activity recognition with a total of seven datasets in different settings. Results demonstrate that DIVERSIFY significantly outperforms other baselines and effectively characterizes the latent distributions by qualitative and quantitative analysis.

Multi-agent reinforcement learning (MARL) recently has achieved tremendous success in a wide range of fields. However, with a black-box neural network architecture, existing MARL methods make decisions in an opaque fashion that hinders humans from understanding the learned knowledge and how input observations influence decisions. Our solution is MIXing Recurrent soft decision Trees (MIXRTs), a novel interpretable architecture that can represent explicit decision processes via the root-to-leaf path of decision trees. We introduce a novel recurrent structure in soft decision trees to address partial observability, and estimate joint action values via linearly mixing outputs of recurrent trees based on local observations only. Theoretical analysis shows that MIXRTs guarantees the structural constraint with additivity and monotonicity in factorization. We evaluate MIXRTs on a range of challenging StarCraft II tasks. Experimental results show that our interpretable learning framework obtains competitive performance compared to widely investigated baselines, and delivers more straightforward explanations and domain knowledge of the decision processes.

The exponentially growing model size drives the continued success of deep learning, but it brings prohibitive computation and memory cost. From the algorithm perspective, model sparsification and quantization have been studied to alleviate the problem. From the architecture perspective, hardware vendors provide Tensor cores for acceleration. However, it is very challenging to gain practical speedups from sparse, low-precision matrix operations on Tensor cores, because of the strict requirements for data layout and lack of support for efficiently manipulating the low-precision integers. We propose Magicube, a high-performance sparse-matrix library for low-precision integers on Tensor cores. Magicube supports SpMM and SDDMM, two major sparse operations in deep learning with mixed precision. Experimental results on an NVIDIA A100 GPU show that Magicube achieves on average 1.44x (up to 2.37x) speedup over the vendor-optimized library for sparse kernels, and 1.43x speedup over the state-of-the-art with a comparable accuracy for end-to-end sparse Transformer inference.

Constrained reinforcement learning is to maximize the expected reward subject to constraints on utilities/costs. However, the training environment may not be the same as the test one, due to, e.g., modeling error, adversarial attack, non-stationarity, resulting in severe performance degradation and more importantly constraint violation. We propose a framework of robust constrained reinforcement learning under model uncertainty, where the MDP is not fixed but lies in some uncertainty set, the goal is to guarantee that constraints on utilities/costs are satisfied for all MDPs in the uncertainty set, and to maximize the worst-case reward performance over the uncertainty set. We design a robust primal-dual approach, and further theoretically develop guarantee on its convergence, complexity and robust feasibility. We then investigate a concrete example of $\delta$-contamination uncertainty set, design an online and model-free algorithm and theoretically characterize its sample complexity.

Contrastive learning is among the most successful methods for visual representation learning, and its performance can be further improved by jointly performing clustering on the learned representations. However, existing methods for joint clustering and contrastive learning do not perform well on long-tailed data distributions, as majority classes overwhelm and distort the loss of minority classes, thus preventing meaningful representations to be learned. Motivated by this, we develop a novel joint clustering and contrastive learning framework by adapting the debiased contrastive loss to avoid under-clustering minority classes of imbalanced datasets. We show that our proposed modified debiased contrastive loss and divergence clustering loss improves the performance across multiple datasets and learning tasks. The source code is available at https://anonymous.4open.science/r/SSL-debiased-clustering

Markov chain Monte Carlo (MCMC), such as Langevin dynamics, is valid for approximating intractable distributions. However, its usage is limited in the context of deep latent variable models owing to costly datapoint-wise sampling iterations and slow convergence. This paper proposes the amortized Langevin dynamics (ALD), wherein datapoint-wise MCMC iterations are entirely replaced with updates of an encoder that maps observations into latent variables. This amortization enables efficient posterior sampling without datapoint-wise iterations. Despite its efficiency, we prove that ALD is valid as an MCMC algorithm, whose Markov chain has the target posterior as a stationary distribution under mild assumptions. Based on the ALD, we also present a new deep latent variable model named the Langevin autoencoder (LAE). Interestingly, the LAE can be implemented by slightly modifying the traditional autoencoder. Using multiple synthetic datasets, we first validate that ALD can properly obtain samples from target posteriors. We also evaluate the LAE on the image generation task, and show that our LAE can outperform existing methods based on variational inference, such as the variational autoencoder, and other MCMC-based methods in terms of the test likelihood.

This paper introduces a new interpretation of the Variational Autoencoder framework by taking a fully geometric point of view. We argue that vanilla VAE models unveil naturally a Riemannian structure in their latent space and that taking into consideration those geometrical aspects can lead to better interpolations and an improved generation procedure. This new proposed sampling method consists in sampling from the uniform distribution deriving intrinsically from the learned Riemannian latent space and we show that using this scheme can make a vanilla VAE competitive and even better than more advanced versions on several benchmark datasets. Since generative models are known to be sensitive to the number of training samples we also stress the method's robustness in the low data regime.

Feature extraction methods help in dimensionality reduction and capture relevant information. In time series forecasting (TSF), features can be used as auxiliary information to achieve better accuracy. Traditionally, features used in TSF are handcrafted, which requires domain knowledge and significant data-engineering work. In this research, we first introduce a notion of static and dynamic features, which then enables us to develop our autonomous Feature Retrieving Autoregressive Network for Static features (FRANS) that does not require domain knowledge. The method is based on a CNN classifier that is trained to create for each series a collective and unique class representation either from parts of the series or, if class labels are available, from a set of series of the same class. It allows to discriminate series with similar behaviour but from different classes and makes the features extracted from the classifier to be maximally discriminatory. We explore the interpretability of our features, and evaluate the prediction capabilities of the method within the forecasting meta-learning environment FFORMA. Our results show that our features lead to improvement in accuracy in most situations. Once trained our approach creates features orders of magnitude faster than statistical methods.

NDCG, namely Normalized Discounted Cumulative Gain, is a widely used ranking metric in information retrieval and machine learning. However, efficient and provable stochastic methods for maximizing NDCG are still lacking, especially for deep models. In this paper, we propose a principled approach to optimize NDCG and its top-$K$ variant. First, we formulate a novel compositional optimization problem for optimizing the NDCG surrogate, and a novel bilevel compositional optimization problem for optimizing the top-$K$ NDCG surrogate. Then, we develop efficient stochastic algorithms with provable convergence guarantees for the non-convex objectives. Different from existing NDCG optimization methods, the per-iteration complexity of our algorithms scales with the mini-batch size instead of the number of total items. To improve the effectiveness for deep learning, we further propose practical strategies by using initial warm-up and stop gradient operator. Experimental results on multiple datasets demonstrate that our methods outperform prior ranking approaches in terms of NDCG. To the best of our knowledge, this is the first time that stochastic algorithms are proposed to optimize NDCG with a provable convergence guarantee. Our proposed methods are implemented in the LibAUC library at https://libauc.org/.

Diffusion models are a new class of generative models that mark a milestone in high-quality image generation while relying on solid probabilistic principles. This makes them promising candidate models for neural image compression. This paper outlines an end-to-end optimized framework based on a conditional diffusion model for image compression. Besides latent variables inherent to the diffusion process, the model introduces an additional per-instance "content" latent variable to condition the denoising process. Upon decoding, the diffusion process conditionally generates/reconstructs an image using ancestral sampling. Our experiments show that this approach outperforms one of the best-performing conventional image codecs (BPG) and one neural codec on two compression benchmarks, where we focus on rate-perception tradeoffs. Qualitatively, our approach shows fewer decompression artifacts than the classical approach.

The subject area known as computational neuroscience involves the investigation of brain function using mathematical techniques and theories. In order to comprehend how the brain processes information, it can also include various methods from signal processing, computer science, and physics. In the present work, for the first time a neurobiological based unsupervised machine learning algorithm i.e., Self-Organizing Map Neural Network is implemented for determining the fracture location in dissimilar friction stir welded AA5754-C11000 alloys. Too Shoulder Diameter (mm), Tool Rotational Speed (RPM), and Tool Traverse Speed (mm/min) are input parameters while the Fracture location i.e. whether the specimen fracture at Thermo-Mechanically Affected Zone (TMAZ) of copper or it fractures at TMAZ of Aluminium. The results showed that the implemented algorithm is able to predict the fracture location with 96.92% accuracy.

Generative Adversarial Networks (GANs) have achieved great success in data generation. However, its statistical properties are not fully understood. In this paper, we consider the statistical behavior of the general $f$-divergence formulation of GAN, which includes the Kullback--Leibler divergence that is closely related to the maximum likelihood principle. We show that for parametric generative models that are correctly specified, all $f$-divergence GANs with the same discriminator classes are asymptotically equivalent under suitable regularity conditions. Moreover, with an appropriately chosen local discriminator, they become equivalent to the maximum likelihood estimate asymptotically. For generative models that are misspecified, GANs with different $f$-divergences {converge to different estimators}, and thus cannot be directly compared. However, it is shown that for some commonly used $f$-divergences, the original $f$-GAN is not optimal in that one can achieve a smaller asymptotic variance when the discriminator training in the original $f$-GAN formulation is replaced by logistic regression. The resulting estimation method is referred to as Adversarial Gradient Estimation (AGE). Empirical studies are provided to support the theory and to demonstrate the advantage of AGE over the original $f$-GANs under model misspecification.

A modern vehicle fitted with sensors, actuators, and Electronic Control Units (ECUs) can be divided into several operational subsystems called Functional Working Groups (FWGs). Examples of these FWGs include the engine system, transmission, fuel system, brakes, etc. Each FWG has associated sensor-channels that gauge vehicular operating conditions. This data rich environment is conducive to the development of Predictive Maintenance (PdM) technologies. Undercutting various PdM technologies is the need for robust anomaly detection models that can identify events or observations which deviate significantly from the majority of the data and do not conform to a well defined notion of normal vehicular operational behavior. In this paper, we introduce the Vehicle Performance, Reliability, and Operations (VePRO) dataset and use it to create a multi-phased approach to anomaly detection. Utilizing Temporal Convolution Networks (TCN), our anomaly detection system can achieve 96% detection accuracy and accurately predicts 91% of true anomalies. The performance of our anomaly detection system improves when sensor channels from multiple FWGs are utilized.

The highest level in the Endsley situation awareness model is called projection when the status of elements in the environment in the near future is predicted. In cybersecurity situation awareness, the projection for an Advanced Persistent Threat (APT) requires predicting the next step of the APT. The threats are constantly changing and becoming more complex. As supervised and unsupervised learning methods require APT datasets for projecting the next step of APTs, they are unable to identify unknown APT threats. In reinforcement learning methods, the agent interacts with the environment, and so it might project the next step of known and unknown APTs. So far, reinforcement learning has not been used to project the next step for APTs. In reinforcement learning, the agent uses the previous states and actions to approximate the best action of the current state. When the number of states and actions is abundant, the agent employs a neural network which is called deep learning to approximate the best action of each state. In this paper, we present a deep reinforcement learning system to project the next step of APTs. As there exists some relation between attack steps, we employ the Long- Short-Term Memory (LSTM) method to approximate the best action of each state. In our proposed system, based on the current situation, we project the next steps of APT threats.

Dynamic magnetic resonance imaging (MRI) is a popular medical imaging technique to generate image sequences of the flow of a contrast material inside tissues and organs. However, its application to imaging bolus movement through the esophagus has only been demonstrated in few feasibility studies and is relatively unexplored. In this work, we present a computational framework called mechanics-informed MRI (MRI-MECH) that enhances that capability thereby increasing the applicability of dynamic MRI for diagnosing esophageal disorders. Pineapple juice was used as the swallowed contrast material for the dynamic MRI and the MRI image sequence was used as input to the MRI-MECH. The MRI-MECH modeled the esophagus as a flexible one-dimensional tube and the elastic tube walls followed a linear tube law. Flow through the esophagus was then governed by one-dimensional mass and momentum conservation equations. These equations were solved using a physics-informed neural network (PINN). The PINN minimized the difference between the measurements from the MRI and model predictions ensuring that the physics of the fluid flow problem was always followed. MRI-MECH calculated the fluid velocity and pressure during esophageal transit and estimated the mechanical health of the esophagus by calculating wall stiffness and active relaxation. Additionally, MRI-MECH predicted missing information about the lower esophageal sphincter during the emptying process, demonstrating its applicability to scenarios with missing data or poor image resolution. In addition to potentially improving clinical decisions based on quantitative estimates of the mechanical health of the esophagus, MRI-MECH can also be enhanced for application to other medical imaging modalities to enhance their functionality as well.

We investigate the potential of adaptive blind equalizers based on variational inference for carrier recovery in optical communications. These equalizers are based on a low-complexity approximation of maximum likelihood channel estimation. We generalize the concept of variational autoencoder (VAE) equalizers to higher order modulation formats encompassing probabilistic constellation shaping (PCS), ubiquitous in optical communications, oversampling at the receiver, and dual-polarization transmission. Besides black-box equalizers based on convolutional neural networks, we propose a model-based equalizer based on a linear butterfly filter and train the filter coefficients using the variational inference paradigm. As a byproduct, the VAE also provides a reliable channel estimation. We analyze the VAE in terms of performance and flexibility over a classical additive white Gaussian noise (AWGN) channel with inter-symbol interference (ISI) and over a dispersive linear optical dual-polarization channel. We show that it can extend the application range of blind adaptive equalizers by outperforming the state-of-the-art constant-modulus algorithm (CMA) for PCS for both fixed but also time-varying channels. The evaluation is accompanied with a hyperparameter analysis.

Graph neural network (GNN) pre-training methods have been proposed to enhance the power of GNNs. Specifically, a GNN is first pre-trained on a large-scale unlabeled graph and then fine-tuned on a separate small labeled graph for downstream applications, such as node classification. One popular pre-training method is to mask out a proportion of the edges, and a GNN is trained to recover them. However, such a generative method suffers from graph mismatch. That is, the masked graph inputted to the GNN deviates from the original graph. To alleviate this issue, we propose DiP-GNN (Discriminative Pre-training of Graph Neural Networks). Specifically, we train a generator to recover identities of the masked edges, and simultaneously, we train a discriminator to distinguish the generated edges from the original graph's edges. In our framework, the graph seen by the discriminator better matches the original graph because the generator can recover a proportion of the masked edges. Extensive experiments on large-scale homogeneous and heterogeneous graphs demonstrate the effectiveness of the proposed framework.

Differential equations play a pivotal role in modern world ranging from science, engineering, ecology, economics and finance where these can be used to model many physical systems and processes. In this paper, we study two mathematical models of a drug assimilation in the human system using Physics Informed Neural Networks (PINNs). In the first model, we consider the case of single dose of drug in the human system and in the second case, we consider the course of this drug taken at regular intervals. We have used the compartment diagram to model these cases. The resulting differential equations are solved using PINN, where we employ a feed forward multilayer perceptron as function approximator and the network parameters are tuned for minimum error. Further, the network is trained by finding the gradient of the error function with respect to the network parameters. We have employed DeepXDE, a python library for PINNs, to solve the simultaneous first order differential equations describing the two models of drug assimilation. The results show high degree of accuracy between the exact solution and the predicted solution as much as the resulting error reaches10^(-11) for the first model and 10^(-8) for the second model. This validates the use of PINN in solving any dynamical system.

Self-supervised pre-training is gaining increasingly more popularity in AI-aided drug discovery, leading to more and more pre-trained models with the promise that they can extract better feature representations for molecules. Yet, the quality of learned representations have not been fully explored. In this work, inspired by the two phenomena of Activity Cliffs (ACs) and Scaffold Hopping (SH) in traditional Quantitative Structure-Activity Relationship (QSAR) analysis, we propose a method named Representation-Property Relationship Analysis (RePRA) to evaluate the quality of the representations extracted by the pre-trained model and visualize the relationship between the representations and properties. The concepts of ACs and SH are generalized from the structure-activity context to the representation-property context, and the underlying principles of RePRA are analyzed theoretically. Two scores are designed to measure the generalized ACs and SH detected by RePRA, and therefore the quality of representations can be evaluated. In experiments, representations of molecules from 10 target tasks generated by 7 pre-trained models are analyzed. The results indicate that the state-of-the-art pre-trained models can overcome some shortcomings of canonical Extended-Connectivity FingerPrints (ECFP), while the correlation between the basis of the representation space and specific molecular substructures are not explicit. Thus, some representations could be even worse than the canonical fingerprints. Our method enables researchers to evaluate the quality of molecular representations generated by their proposed self-supervised pre-trained models. And our findings can guide the community to develop better pre-training techniques to regularize the occurrence of ACs and SH.

Neural Ordinary Differential Equations (Neural ODEs) are the continuous analog of Residual Neural Networks (ResNets). We investigate whether the discrete dynamics defined by a ResNet are close to the continuous one of a Neural ODE. We first quantify the distance between the ResNet's hidden state trajectory and the solution of its corresponding Neural ODE. Our bound is tight and, on the negative side, does not go to 0 with depth N if the residual functions are not smooth with depth. On the positive side, we show that this smoothness is preserved by gradient descent for a ResNet with linear residual functions and small enough initial loss. It ensures an implicit regularization towards a limit Neural ODE at rate 1 over N, uniformly with depth and optimization time. As a byproduct of our analysis, we consider the use of a memory-free discrete adjoint method to train a ResNet by recovering the activations on the fly through a backward pass of the network, and show that this method theoretically succeeds at large depth if the residual functions are Lipschitz with the input. We then show that Heun's method, a second order ODE integration scheme, allows for better gradient estimation with the adjoint method when the residual functions are smooth with depth. We experimentally validate that our adjoint method succeeds at large depth, and that Heun method needs fewer layers to succeed. We finally use the adjoint method successfully for fine-tuning very deep ResNets without memory consumption in the residual layers.

We propose a novel contextual bandit algorithm for generalized linear rewards with an $\tilde{O}(\sqrt{\kappa^{-1} \phi T})$ regret over $T$ rounds where $\phi$ is the minimum eigenvalue of the covariance of contexts and $\kappa$ is a lower bound of the variance of rewards. In several practical cases where $\phi=O(d)$, our result is the first regret bound for generalized linear model (GLM) bandits with the order $\sqrt{d}$ without relying on the approach of Auer [2002]. We achieve this bound using a novel estimator called double doubly-robust (DDR) estimator, a subclass of doubly-robust (DR) estimator but with a tighter error bound. The approach of Auer [2002] achieves independence by discarding the observed rewards, whereas our algorithm achieves independence considering all contexts using our DDR estimator. We also provide an $O(\kappa^{-1} \phi \log (NT) \log T)$ regret bound for $N$ arms under a probabilistic margin condition. Regret bounds under the margin condition are given by Bastani and Bayati [2020] and Bastani et al. [2021] under the setting that contexts are common to all arms but coefficients are arm-specific. When contexts are different for all arms but coefficients are common, ours is the first regret bound under the margin condition for linear models or GLMs. We conduct empirical studies using synthetic data and real examples, demonstrating the effectiveness of our algorithm.

With the development of machine learning techniques, the attention of research has been moved from single-modal learning to multi-modal learning, as real-world data exist in the form of different modalities. However, multi-modal models often carry more information than single-modal models and they are usually applied in sensitive scenarios, such as medical report generation or disease identification. Compared with the existing membership inference against machine learning classifiers, we focus on the problem that the input and output of the multi-modal models are in different modalities, such as image captioning. This work studies the privacy leakage of multi-modal models through the lens of membership inference attack, a process of determining whether a data record involves in the model training process or not. To achieve this, we propose Multi-modal Models Membership Inference (M^4I) with two attack methods to infer the membership status, named metric-based (MB) M^4I and feature-based (FB) M^4I, respectively. More specifically, MB M^4I adopts similarity metrics while attacking to infer target data membership. FB M^4I uses a pre-trained shadow multi-modal feature extractor to achieve the purpose of data inference attack by comparing the similarities from extracted input and output features. Extensive experimental results show that both attack methods can achieve strong performances. Respectively, 72.5% and 94.83% of attack success rates on average can be obtained under unrestricted scenarios. Moreover, we evaluate multiple defense mechanisms against our attacks. The source code of M^4I attacks is publicly available at https://github.com/MultimodalMI/Multimodal-membership-inference.git.

As deep learning is now used in many real-world applications, research has focused increasingly on the privacy of deep learning models and how to prevent attackers from obtaining sensitive information about the training data. However, image-text models like CLIP have not yet been looked at in the context of privacy attacks. While membership inference attacks aim to tell whether a specific data point was used for training, we introduce a new type of privacy attack, named identity inference attack (IDIA), designed for multi-modal image-text models like CLIP. Using IDIAs, an attacker can reveal whether a particular person, was part of the training data by querying the model in a black-box fashion with different images of the same person. Letting the model choose from a wide variety of possible text labels, the attacker can probe the model whether it recognizes the person and, therefore, was used for training. Through several experiments on CLIP, we show that the attacker can identify individuals used for training with very high accuracy and that the model learns to connect the names with the depicted people. Our experiments show that a multi-modal image-text model indeed leaks sensitive information about its training data and, therefore, should be handled with care.

The rapid advancement of models based on artificial intelligence demands innovative monitoring techniques which can operate in real time with low computational costs. In machine learning, especially if we consider neural network (NN) learning algorithms, and in particular deep-learning architectures, the models are often trained in a supervised manner. Consequently, the learned relationship between the input and the output must remain valid during the model's deployment. If this stationarity assumption holds, we can conclude that the NN generates accurate predictions. Otherwise, the retraining or rebuilding of the model is required. We propose to consider the latent feature representation of the data (called "embedding") generated by the NN for determining the time point when the data stream starts being nonstationary. To be precise, we monitor embeddings by applying multivariate control charts based on the calculation of the data depth and normalized ranks. The performance of the introduced method is evaluated using various NNs with different underlying data formats.

Breast tumor segmentation is one of the key steps that helps us characterize and localize tumor regions. However, variable tumor morphology, blurred boundary, and similar intensity distributions bring challenges for accurate segmentation of breast tumors. Recently, many U-net variants have been proposed and widely used for breast tumors segmentation. However, these architectures suffer from two limitations: (1) Ignoring the characterize ability of the benchmark networks, and (2) Introducing extra complex operations increases the difficulty of understanding and reproducing the network. To alleviate these challenges, this paper proposes a simple yet powerful nested U-net (NU-net) for accurate segmentation of breast tumors. The key idea is to utilize U-Nets with different depths and shared weights to achieve robust characterization of breast tumors. NU-net mainly has the following advantages: (1) Improving network adaptability and robustness to breast tumors with different scales, (2) This method is easy to reproduce and execute, and (3) The extra operations increase network parameters without significantly increasing computational cost. Extensive experimental results with twelve state-of-the-art segmentation methods on three public breast ultrasound datasets demonstrate that NU-net has more competitive segmentation performance on breast tumors. Furthermore, the robustness of NU-net is further illustrated on the segmentation of renal ultrasound images. The source code is publicly available on https://github.com/CGPzy/NU-net.

Deep neural networks have largely demonstrated their ability to perform automated speech recognition (ASR) by extracting meaningful features from input audio frames. Such features, however, may consist not only of information about the spoken language content, but also may contain information about unnecessary contexts such as background noise and sounds or speaker identity, accent, or protected attributes. Such information can directly harm generalization performance, by introducing spurious correlations between the spoken words and the context in which such words were spoken. In this work, we introduce an unsupervised, encoder-agnostic method for factoring speech-encoder representations into explicit content-encoding representations and spurious context-encoding representations. By doing so, we demonstrate improved performance on standard ASR benchmarks, as well as improved performance in both real-world and artificially noisy ASR scenarios.

Iterative linear quadratic regulator (iLQR) has gained wide popularity in addressing trajectory optimization problems with nonlinear system models. However, as a model-based shooting method, it relies heavily on an accurate system model to update the optimal control actions and the trajectory determined with forward integration, thus becoming vulnerable to inevitable model inaccuracies. Recently, substantial research efforts in learning-based methods for optimal control problems have been progressing significantly in addressing unknown system models, particularly when the system has complex interactions with the environment. Yet a deep neural network is normally required to fit substantial scale of sampling data. In this work, we present Neural-iLQR, a learning-aided shooting method over the unconstrained control space, in which a neural network with a simple structure is used to represent the local system model. In this framework, the trajectory optimization task is achieved with simultaneous refinement of the optimal policy and the neural network iteratively, without relying on the prior knowledge of the system model. Through comprehensive evaluations on two illustrative control tasks, the proposed method is shown to outperform the conventional iLQR significantly in the presence of inaccuracies in system models.

The matching principles behind optimal transport (OT) play an increasingly important role in machine learning, a trend which can be observed when OT is used to disambiguate datasets in applications (e.g. single-cell genomics) or used to improve more complex methods (e.g. balanced attention in transformers or self-supervised learning). To scale to more challenging problems, there is a growing consensus that OT requires solvers that can operate on millions, not thousands, of points. The low-rank optimal transport (LOT) approach advocated in \cite{scetbon2021lowrank} holds several promises in that regard, and was shown to complement more established entropic regularization approaches, being able to insert itself in more complex pipelines, such as quadratic OT. LOT restricts the search for low-cost couplings to those that have a low-nonnegative rank, yielding linear time algorithms in cases of interest. However, these promises can only be fulfilled if the LOT approach is seen as a legitimate contender to entropic regularization when compared on properties of interest, where the scorecard typically includes theoretical properties (statistical complexity and relation to other methods) or practical aspects (debiasing, hyperparameter tuning, initialization). We target each of these areas in this paper in order to cement the impact of low-rank approaches in computational OT.

Deep learning based approaches like Physics-informed neural networks (PINNs) and DeepONets have shown promise on solving PDE constrained optimization (PDECO) problems. However, existing methods are insufficient to handle those PDE constraints that have a complicated or nonlinear dependency on optimization targets. In this paper, we present a novel bi-level optimization framework to resolve the challenge by decoupling the optimization of the targets and constraints. For the inner loop optimization, we adopt PINNs to solve the PDE constraints only. For the outer loop, we design a novel method by using Broyden's method based on the Implicit Function Theorem (IFT), which is efficient and accurate for approximating hypergradients. We further present theoretical explanations and error analysis of the hypergradients computation. Extensive experiments on multiple large-scale and nonlinear PDE constrained optimization problems demonstrate that our method achieves state-of-the-art results compared with strong baselines.

We propose and explore the possibility that language models can be studied as effective proxies for specific human sub-populations in social science research. Practical and research applications of artificial intelligence tools have sometimes been limited by problematic biases (such as racism or sexism), which are often treated as uniform properties of the models. We show that the "algorithmic bias" within one such tool -- the GPT-3 language model -- is instead both fine-grained and demographically correlated, meaning that proper conditioning will cause it to accurately emulate response distributions from a wide variety of human subgroups. We term this property "algorithmic fidelity" and explore its extent in GPT-3. We create "silicon samples" by conditioning the model on thousands of socio-demographic backstories from real human participants in multiple large surveys conducted in the United States. We then compare the silicon and human samples to demonstrate that the information contained in GPT-3 goes far beyond surface similarity. It is nuanced, multifaceted, and reflects the complex interplay between ideas, attitudes, and socio-cultural context that characterize human attitudes. We suggest that language models with sufficient algorithmic fidelity thus constitute a novel and powerful tool to advance understanding of humans and society across a variety of disciplines.  ( 2 min )

Social media users share their ideas, thoughts, and emotions with other users. However, it is not clear how online users would respond to new research outcomes. This study aims to predict the nature of the emotions expressed by Twitter users toward scientific publications. Additionally, we investigate what features of the research articles help in such prediction. Identifying the sentiments of research articles on social media will help scientists gauge a new societal impact of their research articles.

We present a framework for video modeling based on denoising diffusion probabilistic models that produces long-duration video completions in a variety of realistic environments. We introduce a generative model that can at test-time sample any arbitrary subset of video frames conditioned on any other subset and present an architecture adapted for this purpose. Doing so allows us to efficiently compare and optimize a variety of schedules for the order in which frames in a long video are sampled and use selective sparse and long-range conditioning on previously sampled frames. We demonstrate improved video modeling over prior work on a number of datasets and sample temporally coherent videos over 25 minutes in length. We additionally release a new video modeling dataset and semantically meaningful metrics based on videos generated in the CARLA self-driving car simulator.

This article aims to study intrusion attacks and then develop a novel cyberattack detection framework for blockchain networks. Specifically, we first design and implement a blockchain network in our laboratory. This blockchain network will serve two purposes, i.e., generate the real traffic data (including both normal data and attack data) for our learning models and implement real-time experiments to evaluate the performance of our proposed intrusion detection framework. To the best of our knowledge, this is the first dataset that is synthesized in a laboratory for cyberattacks in a blockchain network. We then propose a novel collaborative learning model that allows efficient deployment in the blockchain network to detect attacks. The main idea of the proposed learning model is to enable blockchain nodes to actively collect data, share the knowledge learned from its data, and then exchange the knowledge with other blockchain nodes in the network. In this way, we can not only leverage the knowledge from all the nodes in the network but also do not need to gather all raw data for training at a centralized node like conventional centralized learning solutions. Such a framework can also avoid the risk of exposing local data's privacy as well as the excessive network overhead/congestion. Both intensive simulations and real-time experiments clearly show that our proposed collaborative learning-based intrusion detection framework can achieve an accuracy of up to 97.7% in detecting attacks.

Traditional machine learning methods face two main challenges in dealing with healthcare predictive analytics tasks. First, the high-dimensional nature of healthcare data needs labor-intensive and time-consuming processes to select an appropriate set of features for each new task. Second, these methods depend on feature engineering to capture the sequential nature of patient data, which may not adequately leverage the temporal patterns of the medical events and their dependencies. Recent deep learning methods have shown promising performance for various healthcare prediction tasks by addressing the high-dimensional and temporal challenges of medical data. These methods can learn useful representations of key factors (e.g., medical concepts or patients) and their interactions from high-dimensional raw or minimally-processed healthcare data. In this paper we systematically reviewed studies focused on advancing and using deep neural networks to leverage patients structured time series data for healthcare prediction tasks. To identify relevant studies, MEDLINE, IEEE, Scopus and ACM digital library were searched for studies published up to February 7th 2021. We found that researchers have contributed to deep time series prediction literature in ten research streams: deep learning models, missing value handling, irregularity handling, patient representation, static data inclusion, attention mechanisms, interpretation, incorporating medical ontologies, learning strategies, and scalability. This study summarizes research insights from these literature streams, identifies several critical research gaps, and suggests future research opportunities for deep learning in patient time series data.

Solving math word problems requires deductive reasoning over the quantities in the text. Various recent research efforts mostly relied on sequence-to-sequence or sequence-to-tree models to generate mathematical expressions without explicitly performing relational reasoning between quantities in the given context. While empirically effective, such approaches typically do not provide explanations for the generated expressions. In this work, we view the task as a complex relation extraction problem, proposing a novel approach that presents explainable deductive reasoning steps to iteratively construct target expressions, where each step involves a primitive operation over two quantities defining their relation. Through extensive experiments on four benchmark datasets, we show that the proposed model significantly outperforms existing strong baselines. We further demonstrate that the deductive procedure not only presents more explainable steps but also enables us to make more accurate predictions on questions that require more complex reasoning.  ( 2 min )

The widespread adoption of deep neural networks in computer vision applications has brought forth a significant interest in adversarial robustness. Existing research has shown that maliciously perturbed inputs specifically tailored for a given model (i.e., adversarial examples) can be successfully transferred to another independently trained model to induce prediction errors. Moreover, this property of adversarial examples has been attributed to features derived from predictive patterns in the data distribution. Thus, we are motivated to investigate the following question: Can adversarial defenses, like adversarial examples, be successfully transferred to other independently trained models? To this end, we propose a deep learning-based pre-processing mechanism, which we refer to as a robust transferable feature extractor (RTFE). After examining theoretical motivation and implications, we experimentally show that our method can provide adversarial robustness to multiple independently pre-trained classifiers that are otherwise ineffective against an adaptive white box adversary. Furthermore, we show that RTFEs can even provide one-shot adversarial robustness to models independently trained on different datasets.  ( 2 min )

Statistical shape modeling aims at capturing shape variations of an anatomical structure that occur within a given population. Shape models are employed in many tasks, such as shape reconstruction and image segmentation, but also shape generation and classification. Existing shape priors either require dense correspondence between training examples or lack robustness and topological guarantees. We present FlowSSM, a novel shape modeling approach that learns shape variability without requiring dense correspondence between training instances. It relies on a hierarchy of continuous deformation flows, which are parametrized by a neural network. Our model outperforms state-of-the-art methods in providing an expressive and robust shape prior for distal femur and liver. We show that the emerging latent representation is discriminative by separating healthy from pathological shapes. Ultimately, we demonstrate its effectiveness on two shape reconstruction tasks from partial data. Our source code is publicly available (https://github.com/davecasp/flowssm).

Determining subgroups that respond especially well (or poorly) to specific interventions (medical or policy) requires new supervised learning methods tailored specifically for causal inference. Bayesian Causal Forest (BCF) is a recent method that has been documented to perform well on data generating processes with strong confounding of the sort that is plausible in many applications. This paper develops a novel algorithm for fitting the BCF model, which is more efficient than the previously available Gibbs sampler. The new algorithm can be used to initialize independent chains of the existing Gibbs sampler leading to better posterior exploration and coverage of the associated interval estimates in simulation studies. The new algorithm is compared to related approaches via simulation studies as well as an empirical analysis.

This paper is concerned with the sample efficiency of reinforcement learning, assuming access to a generative model (or simulator). We first consider $\gamma$-discounted infinite-horizon Markov decision processes (MDPs) with state space $\mathcal{S}$ and action space $\mathcal{A}$. Despite a number of prior works tackling this problem, a complete picture of the trade-offs between sample complexity and statistical accuracy is yet to be determined. In particular, all prior results suffer from a severe sample size barrier, in the sense that their claimed statistical guarantees hold only when the sample size exceeds at least $\frac{|\mathcal{S}||\mathcal{A}|}{(1-\gamma)^2}$. The current paper overcomes this barrier by certifying the minimax optimality of two algorithms -- a perturbed model-based algorithm and a conservative model-based algorithm -- as soon as the sample size exceeds the order of $\frac{|\mathcal{S}||\mathcal{A}|}{1-\gamma}$ (modulo some log factor). Moving beyond infinite-horizon MDPs, we further study time-inhomogeneous finite-horizon MDPs, and prove that a plain model-based planning algorithm suffices to achieve minimax-optimal sample complexity given any target accuracy level. To the best of our knowledge, this work delivers the first minimax-optimal guarantees that accommodate the entire range of sample sizes (beyond which finding a meaningful policy is information theoretically infeasible).  ( 3 min )

Polynomial Networks (PNs) have demonstrated promising performance on face and image recognition recently. However, robustness of PNs is unclear and thus obtaining certificates becomes imperative for enabling their adoption in real-world applications. Existing verification algorithms on ReLU neural networks (NNs) based on branch and bound (BaB) techniques cannot be trivially applied to PN verification. In this work, we devise a new bounding method, equipped with BaB for global convergence guarantees, called VPN. One key insight is that we obtain much tighter bounds than the interval bound propagation baseline. This enables sound and complete PN verification with empirical validation on MNIST, CIFAR10 and STL10 datasets. We believe our method has its own interest to NN verification.  ( 2 min )

Federated learning (FL) is one of the most appealing alternatives to the standard centralized learning paradigm, allowing heterogeneous set of devices to train a machine learning model without sharing their raw data. However, FL requires a central server to coordinate the learning process, thus introducing potential scalability and security issues. In the literature, server-less FL approaches like gossip federated learning (GFL) and blockchain-enabled federated learning (BFL) have been proposed to mitigate these issues. In this work, we propose a complete overview of these three techniques proposing a comparison according to an integral set of performance indicators, including model accuracy, time complexity, communication overhead, convergence time and energy consumption. An extensive simulation campaign permits to draw a quantitative analysis. In particular, GFL is able to save the 18% of training time, the 68% of energy and the 51% of data to be shared with respect to the CFL solution, but it is not able to reach the level of accuracy of CFL. On the other hand, BFL represents a viable solution for implementing decentralized learning with a higher level of security, at the cost of an extra energy usage and data sharing. Finally, we identify open issues on the two decentralized federated learning implementations and provide insights on potential extensions and possible research directions on this new research field.  ( 3 min )

Neural Architecture Search (NAS) has fostered the automatic discovery of neural architectures, which achieve state-of-the-art accuracy in image recognition. Despite the progress achieved with NAS, so far there is little attention to theoretical guarantees on NAS. In this work, we study the generalization properties of NAS under a unifying framework enabling (deep) layer skip connection search and activation function search. To this end, we derive the lower (and upper) bounds of the minimum eigenvalue of Neural Tangent Kernel under the (in)finite width regime from a search space including mixed activation functions, fully connected, and residual neural networks. Our analysis is non-trivial due to the coupling of various architectures and activation functions under the unifying framework. Then, we leverage the eigenvalue bounds to establish generalization error bounds of NAS in the stochastic gradient descent training. Importantly, we theoretically and experimentally show how the derived results can guide NAS to select the top-performing architectures, even in the case without training, leading to a training-free algorithm based on our theory. Accordingly, our numerical validation shed light on the design of computationally efficient methods for NAS.  ( 2 min )

In decision-making problems such as the multi-armed bandit, an agent learns sequentially by optimizing a certain feedback. While the mean reward criterion has been extensively studied, other measures that reflect an aversion to adverse outcomes, such as mean-variance or conditional value-at-risk (CVaR), can be of interest for critical applications (healthcare, agriculture). Algorithms have been proposed for such risk-aware measures under bandit feedback without contextual information. In this work, we study contextual bandits where such risk measures can be elicited as linear functions of the contexts through the minimization of a convex loss. A typical example that fits within this framework is the expectile measure, which is obtained as the solution of an asymmetric least-square problem. Using the method of mixtures for supermartingales, we derive confidence sequences for the estimation of such risk measures. We then propose an optimistic UCB algorithm to learn optimal risk-aware actions, with regret guarantees similar to those of generalized linear bandits. This approach requires solving a convex problem at each round of the algorithm, which we can relax by allowing only approximated solution obtained by online gradient descent, at the cost of slightly higher regret. We conclude by evaluating the resulting algorithms on numerical experiments.  ( 2 min )

Disentangled and invariant representations are two critical goals of representation learning and many approaches have been proposed to achieve either one of them. However, those two goals are actually complementary to each other so that we propose a framework to accomplish both of them simultaneously. We introduce a weakly supervised signal to learn disentangled representation which consists of three splits containing predictive, known nuisance and unknown nuisance information respectively. Furthermore, we incorporate contrastive method to enforce representation invariance. Experiments shows that the proposed method outperforms state-of-the-art (SOTA) methods on four standard benchmarks and shows that the proposed method can have better adversarial defense ability comparing to other methods without adversarial training.  ( 2 min )

How can we train an assistive human-machine interface (e.g., an electromyography-based limb prosthesis) to translate a user's raw command signals into the actions of a robot or computer when there is no prior mapping, we cannot ask the user for supervision in the form of action labels or reward feedback, and we do not have prior knowledge of the tasks the user is trying to accomplish? The key idea in this paper is that, regardless of the task, when an interface is more intuitive, the user's commands are less noisy. We formalize this idea as a completely unsupervised objective for optimizing interfaces: the mutual information between the user's command signals and the induced state transitions in the environment. To evaluate whether this mutual information score can distinguish between effective and ineffective interfaces, we conduct an observational study on 540K examples of users operating various keyboard and eye gaze interfaces for typing, controlling simulated robots, and playing video games. The results show that our mutual information scores are predictive of the ground-truth task completion metrics in a variety of domains, with an average Spearman's rank correlation of 0.43. In addition to offline evaluation of existing interfaces, we use our unsupervised objective to learn an interface from scratch: we randomly initialize the interface, have the user attempt to perform their desired tasks using the interface, measure the mutual information score, and update the interface to maximize mutual information through reinforcement learning. We evaluate our method through a user study with 12 participants who perform a 2D cursor control task using a perturbed mouse, and an experiment with one user playing the Lunar Lander game using hand gestures. The results show that we can learn an interface from scratch, without any user supervision or prior knowledge of tasks, in under 30 minutes.  ( 3 min )

In this work, we study the simple yet universally applicable case of reward shaping in value-based Deep Reinforcement Learning (DRL). We show that reward shifting in the form of the linear transformation is equivalent to changing the initialization of the $Q$-function in function approximation. Based on such an equivalence, we bring the key insight that a positive reward shifting leads to conservative exploitation, while a negative reward shifting leads to curiosity-driven exploration. Accordingly, conservative exploitation improves offline RL value estimation, and optimistic value estimation improves exploration for online RL. We validate our insight on a range of RL tasks and show its improvement over baselines: (1) In offline RL, the conservative exploitation leads to improved performance based on off-the-shelf algorithms; (2) In online continuous control, multiple value functions with different shifting constants can be used to tackle the exploration-exploitation dilemma for better sample efficiency; (3) In discrete control tasks, a negative reward shifting yields an improvement over the curiosity-based exploration method.  ( 2 min )

We propose a certainty-equivalence scheme for adaptive control of scalar linear systems subject to additive, i.i.d. Gaussian disturbances and bounded control input constraints, without requiring prior knowledge of the bounds of the system parameters, nor the control direction. Assuming that the system is at-worst marginally stable, mean square boundedness of the closed-loop system states is proven. Lastly, numerical examples are presented to illustrate our results.  ( 2 min )

Conventional frequentist FL schemes are known to yield overconfident decisions. Bayesian FL addresses this issue by allowing agents to process and exchange uncertainty information encoded in distributions over the model parameters. However, this comes at the cost of a larger per-iteration communication overhead. This letter investigates whether Bayesian FL can still provide advantages in terms of calibration when constraining communication bandwidth. We present compressed particle-based Bayesian FL protocols for FL and federated "unlearning" that apply quantization and sparsification across multiple particles. The experimental results confirm that the benefits of Bayesian FL are robust to bandwidth constraints.  ( 2 min )

Modelling long-range dependencies is critical for scene understanding tasks in computer vision. Although CNNs have excelled in many vision tasks, they are still limited in capturing long-range structured relationships as they typically consist of layers of local kernels. A fully-connected graph is beneficial for such modelling, however, its computational overhead is prohibitive. We propose a dynamic graph message passing network, that significantly reduces the computational complexity compared to related works modelling a fully-connected graph. This is achieved by adaptively sampling nodes in the graph, conditioned on the input, for message passing. Based on the sampled nodes, we dynamically predict node-dependent filter weights and the affinity matrix for propagating information between them. Using this model, we show significant improvements with respect to strong, state-of-the-art baselines on three different tasks and backbone architectures. Our approach also outperforms fully-connected graphs while using substantially fewer floating-point operations and parameters. The project website is this http URL  ( 2 min )

Designing learning systems which are invariant to certain data transformations is critical in machine learning. Practitioners can typically enforce a desired invariance on the trained model through the choice of a network architecture, e.g. using convolutions for translations, or using data augmentation. Yet, enforcing true invariance in the network can be difficult, and data invariances are not always known a piori. State-of-the-art methods for learning data augmentation policies require held-out data and are based on bilevel optimization problems, which are complex to solve and often computationally demanding. In this work we investigate new ways of learning invariances only from the training data. Using learnable augmentation layers built directly in the network, we demonstrate that our method is very versatile. It can incorporate any type of differentiable augmentation and be applied to a broad class of learning problems beyond computer vision. We provide empirical evidence showing that our approach is easier and faster to train than modern automatic data augmentation techniques based on bilevel optimization, while achieving comparable results. Experiments show that while the invariances transferred to a model through automatic data augmentation are limited by the model expressivity, the invariance yielded by our approach is insensitive to it by design.  ( 3 min )

The objective of this paper is to employ machine learning (ML) and deep learning (DL) techniques to obtain from input data (storm features) available in or derived from the HURDAT2 database models capable of simulating important hurricane properties such as landfall location and wind speed that are consistent with historical records. In pursuit of this objective, a trajectory model providing the storm center in terms of longitude and latitude, and intensity models providing the central pressure and maximum 1-$min$ wind speed at 10 $m$ elevation were created. The trajectory and intensity models are coupled and must be advanced together, six hours at a time, as the features that serve as inputs to the models at any given step depend on predictions at the previous time steps. Once a synthetic storm database is generated, properties of interest, such as the frequencies of large wind speeds may be extracted from any part of the simulation domain. The coupling of the trajectory and intensity models obviates the need for an intensity decay inland of the coastline. Prediction results are compared to historical data, and the efficacy of the storm simulation models is demonstrated for three examples: New Orleans, Miami and Cape Hatteras.  ( 2 min )

Communal hill-climbing, via comparison of algorithm performances, can greatly accelerate ML research. However, it requires task-relevant metrics. For diseases involving parasite loads, e.g., malaria and neglected tropical diseases (NTDs) such as schistosomiasis, the metrics currently reported in ML papers (e.g., AUC, F1 score) are ill-suited to the clinical task. As a result, the hill-climbing system is not enabling progress towards solutions that address these dire illnesses. Drawing on examples from malaria and NTDs, this paper highlights two gaps in current ML practice and proposes methods for improvement: (i) We describe aspects of ML development, and performance metrics in particular, that need to be firmly grounded in the clinical use case, and we offer methods for acquiring this domain knowledge. (ii) We describe in detail performance metrics to guide development of ML models for diseases involving parasite loads. We highlight the importance of a patient-level perspective, interpatient variability, false positive rates, limit of detection, and different types of error. We also discuss problems with ROC curves and AUC as commonly used in this context.

We show how to take a regression function $\hat{f}$ that is appropriately ``multicalibrated'' and efficiently post-process it into an approximately error minimizing classifier satisfying a large variety of fairness constraints. The post-processing requires no labeled data, and only a modest amount of unlabeled data and computation. The computational and sample complexity requirements of computing $\hat f$ are comparable to the requirements for solving a single fair learning task optimally, but it can in fact be used to solve many different downstream fairness-constrained learning problems efficiently. Our post-processing method easily handles intersecting groups, generalizing prior work on post-processing regression functions to satisfy fairness constraints that only applied to disjoint groups. Our work extends recent work showing that multicalibrated regression functions are ``omnipredictors'' (i.e. can be post-processed to optimally solve unconstrained ERM problems) to constrained optimization.

We establish the first nonasymptotic error bounds for Kaplan-Meier-based nearest neighbor and kernel survival probability estimators where feature vectors reside in metric spaces. Our bounds imply rates of strong consistency for these nonparametric estimators and, up to a log factor, match an existing lower bound for conditional CDF estimation. Our proof strategy also yields nonasymptotic guarantees for nearest neighbor and kernel variants of the Nelson-Aalen cumulative hazards estimator. We experimentally compare these methods on four datasets. We find that for the kernel survival estimator, a good choice of kernel is one learned using random survival forests.

As input distributions evolve over a mission lifetime, maintaining performance of learning-based models becomes challenging. This paper presents a framework to incrementally retrain a model by selecting a subset of test inputs to label, which allows the model to adapt to changing input distributions. Algorithms within this framework are evaluated based on (1) model performance throughout mission lifetime and (2) cumulative costs associated with labeling and model retraining. We provide an open-source benchmark of a satellite pose estimation model trained on images of a satellite in space and deployed in novel scenarios (e.g., different backgrounds or misbehaving pixels), where algorithms are evaluated on their ability to maintain high performance by retraining on a subset of inputs. We also propose a novel algorithm to select a diverse subset of inputs for labeling, by characterizing the information gain from an input using Bayesian uncertainty quantification and choosing a subset that maximizes collective information gain using concepts from batch active learning. We show that our algorithm outperforms others on the benchmark, e.g., achieves comparable performance to an algorithm that labels 100% of inputs, while only labeling 50% of inputs, resulting in low costs and high performance over the mission lifetime.  ( 2 min )

In recent years, deep learning has been a topic of interest in almost all disciplines due to its impressive empirical success in analyzing complex data sets, such as imaging, genetics, climate, and medical data. While most of the developments are treated as black-box machines, there is an increasing interest in interpretable, reliable, and robust deep learning models applicable to a broad class of applications. Feature-selected deep learning is proven to be promising in this regard. However, the recent developments do not address the situations of ultra-high dimensional and highly correlated feature selection in addition to the high noise level. In this article, we propose a novel screening and cleaning strategy with the aid of deep learning for the cluster-level discovery of highly correlated predictors with a controlled error rate. A thorough empirical evaluation over a wide range of simulated scenarios demonstrates the effectiveness of the proposed method by achieving high power while having a minimal number of false discoveries. Furthermore, we implemented the algorithm in the riboflavin (vitamin $B_2$) production dataset in the context of understanding the possible genetic association with riboflavin production. The gain of the proposed methodology is illustrated by achieving lower prediction error compared to other state-of-the-art methods.  ( 2 min )

The iterative weight update for the AdaBoost machine learning algorithm may be realized as a dynamical map on a probability simplex. When learning a low-dimensional data set this algorithm has a tendency towards cycling behavior, which is the topic of this paper. AdaBoost's cycling behavior lends itself to direct computational methods that are ineffective in the general, non-cycling case of the algorithm. From these computational properties we give a concrete correspondence between AdaBoost's cycling behavior and continued fractions dynamics. Then we explore the results of this correspondence to expound on how the algorithm comes to be in this periodic state at all. What we intend for this work is to be a novel and self-contained explanation for the cycling dynamics of this machine learning algorithm.  ( 2 min )

In recent years novel architecture components for image classification have been developed, starting with attention and patches used in transformers. While prior works have analyzed the influence of some aspects of architecture components on the robustness to adversarial attacks, in particular for vision transformers, the understanding of the main factors is still limited. We compare several (non)-robust classifiers with different architectures and study their properties, including the effect of adversarial training on the interpretability of the learnt features and robustness to unseen threat models. An ablation from ResNet to ConvNeXt reveals key architectural changes leading to almost $10\%$ higher $\ell_\infty$-robustness.  ( 2 min )

Object-centric representations form the basis of human perception, and enable us to reason about the world and to systematically generalize to new settings. Currently, most works on unsupervised object discovery focus on slot-based approaches, which explicitly separate the latent representations of individual objects. While the result is easily interpretable, it usually requires the design of involved architectures. In contrast to this, we propose a comparatively simple approach - the Complex AutoEncoder (CAE) - that creates distributed object-centric representations. Following a coding scheme theorized to underlie object representations in biological neurons, its complex-valued activations represent two messages: their magnitudes express the presence of a feature, while the relative phase differences between neurons express which features should be bound together to create joint object representations. In contrast to previous approaches using complex-valued activations for object discovery, we present a fully unsupervised approach that is trained end-to-end - resulting in significant improvements in performance and efficiency. Further, we show that the CAE achieves competitive or better unsupervised object discovery performance on simple multi-object datasets compared to a state-of-the-art slot-based approach while being up to 100 times faster to train.

Decentralized learning offers privacy and communication efficiency when data are naturally distributed among agents communicating over an underlying graph. Motivated by overparameterized learning settings, in which models are trained to zero training loss, we study algorithmic and generalization properties of decentralized learning with gradient descent on separable data. Specifically, for decentralized gradient descent (DGD) and a variety of loss functions that asymptote to zero at infinity (including exponential and logistic losses), we derive novel finite-time generalization bounds. This complements a long line of recent work that studies the generalization performance and the implicit bias of gradient descent over separable data, but has thus far been limited to centralized learning scenarios. Notably, our generalization bounds match in order their centralized counterparts. Critical behind this, and of independent interest, is establishing novel bounds on the training loss and the rate-of-consensus of DGD for a class of self-bounded losses. Finally, on the algorithmic front, we design improved gradient-based routines for decentralized learning with separable data and empirically demonstrate orders-of-magnitude of speed-up in terms of both training and generalization performance.

Given a valued graph, where both the nodes and the edges of the graph are associated with one or several values, any network function for a given node must be defined in terms of that node and its connected nodes in the graph. Generally, applying the same definition to the whole graph or any given subgraph of it would result in systematically different network functions. In this paper we consider the feasibility of graph sampling approach to network function learning, as well as the corresponding learning methods based on the sample graphs. This can be useful either when the edges are unknown to start with or the graph is too large (or dynamic) to be processed entirely.

Self-Adaptive Multi-Agent Systems (AMAS) transform machine learning problems into problems of local cooperation between agents. We present smapy, an ensemble based AMAS implementation for mobility prediction, whose agents are provided with machine learning models in addition to their cooperation rules. With a detailed methodology, we show that it is possible to use linear models for nonlinear classification on a benchmark transport mode detection dataset, if they are integrated in a cooperative multi-agent structure. The results obtained show a significant improvement of the performance of linear models in non-linear contexts thanks to the multi-agent approach.  ( 2 min )

Due to the rapid development of autonomous driving, the Internet of Things and streaming services, modern communication systems have to cope with varying channel conditions and a steadily rising number of users and devices. This, and the still rising bandwidth demands, can only be met by intelligent network automation, which requires highly flexible and blind transceiver algorithms. To tackle those challenges, we propose a novel adaptive equalization scheme, which exploits the prosperous advances in deep learning by training an equalizer with an adversarial network. The learning is only based on the statistics of the transmit signal, so it is blind regarding the actual transmit symbols and agnostic to the channel model. The proposed approach is independent of the equalizer topology and enables the application of powerful neural network based equalizers. In this work, we prove this concept in simulations of different -- both linear and nonlinear -- transmission channels and demonstrate the capability of the proposed blind learning scheme to approach the performance of non-blind equalizers. Furthermore, we provide a theoretical perspective and highlight the challenges of the approach.  ( 2 min )

We consider the problem of estimating the skeleton of a large causal polytree from a relatively small i.i.d. sample. This is motivated by the problem of determining causal structure when the number of variables is very large compared to the sample size, such as in gene regulatory networks. We give an algorithm that recovers the tree with high accuracy in such settings. The algorithm works under essentially no distributional or modeling assumptions other than some mild non-degeneracy conditions.  ( 2 min )

Counterfactual risk minimization is a framework for offline policy optimization with logged data which consists of context, action, propensity score, and reward for each sample point. In this work, we build on this framework and propose a learning method for settings where the rewards for some samples are not observed, and so the logged data consists of a subset of samples with unknown rewards and a subset of samples with known rewards. This setting arises in many application domains, including advertising and healthcare. While reward feedback is missing for some samples, it is possible to leverage the unknown-reward samples in order to minimize the risk, and we refer to this setting as semi-counterfactual risk minimization. To approach this kind of learning problem, we derive new upper bounds on the true risk under the inverse propensity score estimator. We then build upon these bounds to propose a regularized counterfactual risk minimization method, where the regularization term is based on the logged unknown-rewards dataset only; hence it is reward-independent. We also propose another algorithm based on generating pseudo-rewards for the logged unknown-rewards dataset. Experimental results with neural networks and benchmark datasets indicate that these algorithms can leverage the logged unknown-rewards dataset besides the logged known-reward dataset.  ( 2 min )

Neural Architecture Search (NAS) has significantly improved productivity in the design and deployment of neural networks (NN). As NAS typically evaluates multiple models by training them partially or completely, the improved productivity comes at the cost of significant carbon footprint. To alleviate this expensive training routine, zero-shot/cost proxies analyze an NN at initialization to generate a score, which correlates highly with its true accuracy. Zero-cost proxies are currently designed by experts conducting multiple cycles of empirical testing on possible algorithms, data-sets, and neural architecture design spaces. This lowers productivity and is an unsustainable approach towards zero-cost proxy design as deep learning use-cases diversify in nature. Additionally, existing zero-cost proxies fail to generalize across neural architecture design spaces. In this paper, we propose a genetic programming framework to automate the discovery of zero-cost proxies for neural architecture scoring. Our methodology efficiently discovers an interpretable and generalizable zero-cost proxy that gives state of the art score-accuracy correlation on all data-sets and search spaces of NASBench-201 and Network Design Spaces (NDS). We believe that this research indicates a promising direction towards automatically discovering zero-cost proxies that can work across network architecture design spaces, data-sets, and tasks.  ( 2 min )

Despite decades of research on authorship attribution (AA) and authorship verification (AV), inconsistent dataset splits/filtering and mismatched evaluation methods make it difficult to assess the state of the art. In this paper, we present a survey of the fields, resolve points of confusion, introduce Valla that standardizes and benchmarks AA/AV datasets and metrics, provide a large-scale empirical evaluation, and provide apples-to-apples comparisons between existing methods. We evaluate eight promising methods on fifteen datasets (including distribution-shifted challenge sets) and introduce a new large-scale dataset based on texts archived by Project Gutenberg. Surprisingly, we find that a traditional Ngram-based model performs best on 5 (of 7) AA tasks, achieving an average macro-accuracy of $76.50\%$ (compared to $66.71\%$ for a BERT-based model). However, on the two AA datasets with the greatest number of words per author, as well as on the AV datasets, BERT-based models perform best. While AV methods are easily applied to AA, they are seldom included as baselines in AA papers. We show that through the application of hard-negative mining, AV methods are competitive alternatives to AA methods. Valla and all experiment code can be found here: https://github.com/JacobTyo/Valla  ( 2 min )

Clustering is an important exploratory data analysis technique to group objects based on their similarity. The widely used $K$-means clustering method relies on some notion of distance to partition data into a fewer number of groups. In the Euclidean space, centroid-based and distance-based formulations of the $K$-means are equivalent. In modern machine learning applications, data often arise as probability distributions and a natural generalization to handle measure-valued data is to use the optimal transport metric. Due to non-negative Alexandrov curvature of the Wasserstein space, barycenters suffer from regularity and non-robustness issues. The peculiar behaviors of Wasserstein barycenters may make the centroid-based formulation fail to represent the within-cluster data points, while the more direct distance-based $K$-means approach and its semidefinite program (SDP) relaxation are capable of recovering the true cluster labels. In the special case of clustering Gaussian distributions, we show that the SDP relaxed Wasserstein $K$-means can achieve exact recovery given the clusters are well-separated under the $2$-Wasserstein metric. Our simulation and real data examples also demonstrate that distance-based $K$-means can achieve better classification performance over the standard centroid-based $K$-means for clustering probability distributions and images.  ( 2 min )

Variational Bayesian posterior inference often requires simplifying approximations such as mean-field parametrisation to ensure tractability. However, prior work has associated the variational mean-field approximation for Bayesian neural networks with underfitting in the case of small datasets or large model sizes. In this work, we show that invariances in the likelihood function of over-parametrised models contribute to this phenomenon because these invariances complicate the structure of the posterior by introducing discrete and/or continuous modes which cannot be well approximated by Gaussian mean-field distributions. In particular, we show that the mean-field approximation has an additional gap in the evidence lower bound compared to a purpose-built posterior that takes into account the known invariances. Importantly, this invariance gap is not constant; it vanishes as the approximation reverts to the prior. We proceed by first considering translation invariances in a linear model with a single data point in detail. We show that, while the true posterior can be constructed from a mean-field parametrisation, this is achieved only if the objective function takes into account the invariance gap. Then, we transfer our analysis of the linear model to neural networks. Our analysis provides a framework for future work to explore solutions to the invariance problem.  ( 2 min )

Score-based divergences have been widely used in machine learning and statistics applications. Despite their empirical success, a blindness problem has been observed when using these for multi-modal distributions. In this work, we discuss the blindness problem and propose a new family of divergences that can mitigate the blindness problem. We illustrate our proposed divergence in the context of density estimation and report improved performance compared to traditional approaches.  ( 2 min )

Topological data analysis (TDA) studies the shape patterns of data. Persistent homology is a widely used method in TDA that summarizes homological features of data at multiple scales and stores them in persistence diagrams (PDs). In this paper, we propose a random persistence diagram generator (RPDG) method that generates a sequence of random PDs from the ones produced by the data. RPDG is underpinned by a model based on pairwise interacting point processes, and a reversible jump Markov chain Monte Carlo (RJ-MCMC) algorithm. A first example, which is based on a synthetic dataset, demonstrates the efficacy of RPDG and provides a comparison with another method for sampling PDs. A second example demonstrates the utility of RPDG to solve a materials science problem given a real dataset of small sample size.  ( 2 min )

Equivariant neural networks, whose hidden features transform according to representations of a group G acting on the data, exhibit training efficiency and an improved generalisation performance. In this work, we extend group invariant and equivariant representation learning to the field of unsupervised deep learning. We propose a general learning strategy based on an encoder-decoder framework in which the latent representation is separated in an invariant term and an equivariant group action component. The key idea is that the network learns to encode and decode data to and from a group-invariant representation by additionally learning to predict the appropriate group action to align input and output pose to solve the reconstruction task. We derive the necessary conditions on the equivariant encoder, and we present a construction valid for any G, both discrete and continuous. We describe explicitly our construction for rotations, translations and permutations. We test the validity and the robustness of our approach in a variety of experiments with diverse data types employing different network architectures.  ( 2 min )

Covering option discovery has been developed to improve the exploration of reinforcement learning in single-agent scenarios with sparse reward signals, through connecting the most distant states in the embedding space provided by the Fiedler vector of the state transition graph. However, these option discovery methods cannot be directly extended to multi-agent scenarios, since the joint state space grows exponentially with the number of agents in the system. Thus, existing researches on adopting options in multi-agent scenarios still rely on single-agent option discovery and fail to directly discover the joint options that can improve the connectivity of the joint state space of agents. In this paper, we show that it is indeed possible to directly compute multi-agent options with collaborative exploratory behaviors among the agents, while still enjoying the ease of decomposition. Our key idea is to approximate the joint state space as a Kronecker graph -- the Kronecker product of individual agents' state transition graphs, based on which we can directly estimate the Fiedler vector of the joint state space using the Laplacian spectrum of individual agents' transition graphs. This decomposition enables us to efficiently construct multi-agent joint options by encouraging agents to connect the sub-goal joint states which are corresponding to the minimum or maximum values of the estimated joint Fiedler vector. The evaluation based on multi-agent collaborative tasks shows that the proposed algorithm can successfully identify multi-agent options, and significantly outperforms prior works using single-agent options or no options, in terms of both faster exploration and higher cumulative rewards.  ( 3 min )

We propose PATRON, a new method that uses prompt-based uncertainty estimation for data selection for pre-trained language model fine-tuning under cold-start scenarios, i.e., no initial labeled data are available. In PATRON, we design (1) a prompt-based uncertainty propagation approach to estimate the importance of data points and (2) a partition-then-rewrite (PTR) strategy to promote sample diversity when querying for annotations. Experiments on six text classification datasets show that PATRON outperforms the strongest cold-start data selection baselines by up to 6.9%. Besides, with 128 labels only, PATRON achieves 91.0% and 92.1% of the fully supervised performance based on vanilla fine-tuning and prompt-based learning respectively. Our implementation of PATRON is available at \url{https://github.com/yueyu1030/Patron}.  ( 2 min )

The advent of Fifth Generation (5G) and beyond 5G networks (5G+) has revolutionized the way network operators consider the management and orchestration of their networks. With an increased focus on intelligence and automation through core network functions such as the NWDAF, service providers are tasked with integrating machine learning models and artificial intelligence systems into their existing network operation practices. Due to the dynamic nature of next-generation networks and their supported use cases and applications, model drift is a serious concern, which can deteriorate the performance of intelligent models deployed throughout the network. The work presented in this paper introduces a model drift detection and adaptation module for 5G core networks. Using a functional prototype of a 5G core network, a drift in user behaviour is emulated, and the proposed framework is deployed and tested. The results of this work demonstrate the ability of the drift detection module to accurately characterize a drifted concept as well as the ability of the drift adaptation module to begin the necessary remediation efforts to restore system performance.  ( 2 min )

We provide a new method for online learning, specifically prediction with expert advice, in a changing environment. In a non-changing environment the Squint algorithm has been designed to always function at least as well as other known algorithms and in specific cases it functions much better. However, when using a conventional black-box algorithm to make Squint suitable for a changing environment, it loses its beneficial properties. Hence, we provide a new algorithm, Squint-CE, which is suitable for a changing environment and preserves the properties of Squint.  ( 2 min )

Integration of Machine Learning (ML) components in critical applications introduces novel challenges for software certification and verification. New safety standards and technical guidelines are under development to support the safety of ML-based systems, e.g., ISO 21448 SOTIF for the automotive domain and the Assurance of Machine Learning for use in Autonomous Systems (AMLAS) framework. SOTIF and AMLAS provide high-level guidance but the details must be chiseled out for each specific case. We initiated a research project with the goal to demonstrate a complete safety case for an ML component in an open automotive system. This paper reports results from an industry-academia collaboration on safety assurance of SMIRK, an ML-based pedestrian automatic emergency braking demonstrator running in an industry-grade simulator. We demonstrate an application of AMLAS on SMIRK for a minimalistic operational design domain, i.e., we share a complete safety case for its integrated ML-based component. Finally, we report lessons learned and provide both SMIRK and the safety case under an open-source licence for the research community to reuse.  ( 3 min )

With exponential growth in the human population, it is vital to conserve natural resources without compromising on producing enough food to feed everyone. Doing so can improve people's livelihoods, health, and ecosystems for the present and future generations. Sustainable development, a paradigm of the United Nations, is rooted in food, crop, livestock, forest, population, and even the emission of gases. By understanding the overall usage of natural resources in different countries in the past, it is possible to forecast the demand in each country. The proposed solution consists of implementing a machine learning system using a statistical regression model that can predict the top k products that would endure a shortage in each country in a specific period in the future. The prediction performance in terms of absolute error and root mean square error show promising results due to its low errors. This solution could help organizations and manufacturers understand the productivity and sustainability needed to satisfy the global demand.  ( 2 min )

This document, as the title stated, is meant to provide a vectorized implementation of adjoint dynamics calculation for Graph Convolutional Neural Ordinary Differential Equations (GCDE). The adjoint sensitivity method is the gradient approximation method for neural ODEs that replaces the back propagation. When implemented on libraries such as PyTorch or Tensorflow, the adjoint can be calculated by autograd functions without the need for a hand-derived formula. In applications such as edge computing and in memristor crossbars, however, autograds are not available, and therefore we need a vectorized derivation of adjoint dynamics to efficiently map the system on hardware. This document will go over the basics, then move on to derive the vectorized adjoint dynamics for GCDE.  ( 2 min )

This paper presents a statistical model for stationary ergodic point processes, estimated from a single realization observed in a square window. With existing approaches in stochastic geometry, it is very difficult to model processes with complex geometries formed by a large number of particles. Inspired by recent works on gradient descent algorithms for sampling maximum-entropy models, we describe a model that allows for fast sampling of new configurations reproducing the statistics of the given observation. Starting from an initial random configuration, its particles are moved according to the gradient of an energy, in order to match a set of prescribed moments (functionals). Our moments are defined via a phase harmonic operator on the wavelet transform of point patterns. They allow one to capture multi-scale interactions between the particles, while controlling explicitly the number of moments by the scales of the structures to model. We present numerical experiments on point processes with various geometric structures, and assess the quality of the model by spectral and topological data analysis.  ( 3 min )

The increasing size of recently proposed Neural Networks makes it hard to implement them on embedded devices, where memory, battery and computational power are a non-trivial bottleneck. For this reason during the last years network compression literature has been thriving and a large number of solutions has been been published to reduce both the number of operations and the parameters involved with the models. Unfortunately, most of these reducing techniques are actually heuristic methods and usually require at least one re-training step to recover the accuracy. The need of procedures for model reduction is well-known also in the fields of Verification and Performances Evaluation, where large efforts have been devoted to the definition of quotients that preserve the observable underlying behaviour. In this paper we try to bridge the gap between the most popular and very effective network reduction strategies and formal notions, such as lumpability, introduced for verification and evaluation of Markov Chains. Elaborating on lumpability we propose a pruning approach that reduces the number of neurons in a network without using any data or fine-tuning, while completely preserving the exact behaviour. Relaxing the constraints on the exact definition of the quotienting method we can give a formal explanation of some of the most common reduction techniques.  ( 2 min )

Despite the success of large-scale empirical risk minimization (ERM) at achieving high accuracy across a variety of machine learning tasks, fair ERM is hindered by the incompatibility of fairness constraints with stochastic optimization. We consider the problem of fair classification with discrete sensitive attributes and potentially large models and data sets, requiring stochastic solvers. Existing in-processing fairness algorithms are either impractical in the large-scale setting because they require large batches of data at each iteration or they are not guaranteed to converge. In this paper, we develop the first stochastic in-processing fairness algorithm with guaranteed convergence. For demographic parity, equalized odds, and equal opportunity notions of fairness, we provide slight variations of our algorithm--called FERMI--and prove that each of these variations converges in stochastic optimization with any batch size. Empirically, we show that FERMI is amenable to stochastic solvers with multiple (non-binary) sensitive attributes and non-binary targets, performing well even with minibatch size as small as one. Extensive experiments show that FERMI achieves the most favorable tradeoffs between fairness violation and test accuracy across all tested setups compared with state-of-the-art baselines for demographic parity, equalized odds, equal opportunity. These benefits are especially significant with small batch sizes and for non-binary classification with large number of sensitive attributes, making FERMI a practical fairness algorithm for large-scale problems.  ( 3 min )

Treatment decisions in cancer care are guided by treatment effect estimates from randomized controlled trials (RCTs). RCTs estimate the average effect of one treatment versus another in a certain population. However, treatments may not be equally effective for every patient in a population. Knowing the effectiveness of treatments tailored to specific patient and tumor characteristics would enable individualized treatment decisions. Getting tailored treatment effects by averaging outcomes in different patient subgroups in RCTs requires an unfeasible number of patients to have sufficient statistical power in all relevant subgroups for all possible treatments. The American Joint Committee on Cancer (AJCC) recommends that researchers develop outcome prediction models (OPMs) in an effort to individualize treatment decisions. OPMs sometimes called risk models or prognosis models, use patient and tumor characteristics to predict a patient outcome such as overall survival. The assumption is that the predictions are useful for treatment decisions using rules such as "prescribe chemotherapy only if the OPM predicts the patient has a high risk of recurrence". Recognizing the importance of reliable predictions, the AJCC published a checklist for OPMs to ensure dependable OPM prediction accuracy in the patient population for which the OPM was designed. However, accurate outcome predictions do not imply that these predictions yield good treatment decisions. In this perspective, we show that OPM rely on a fixed treatment policy which implies that OPM that were found to accurately predict outcomes in validation studies can still lead to patient harm when used to inform treatment decisions. We then give guidance on how to develop models that are useful for individualized treatment decisions and how to evaluate whether a model has value for decision-making.  ( 3 min )

Solar flare prediction is a central problem in space weather forecasting and has captivated the attention of a wide spectrum of researchers due to recent advances in both remote sensing as well as machine learning and deep learning approaches. The experimental findings based on both machine and deep learning models reveal significant performance improvements for task specific datasets. Along with building models, the practice of deploying such models to production environments under operational settings is a more complex and often time-consuming process which is often not addressed directly in research settings. We present a set of new heuristic approaches to train and deploy an operational solar flare prediction system for $\geq$M1.0-class flares with two prediction modes: full-disk and a…  ( 3 min )

We study the problem of high-dimensional sparse linear regression in a distributed setting under both computational and communication constraints. Specifically, we consider a star topology network whereby several machines are connected to a fusion center, with whom they can exchange relatively short messages. Each machine holds noisy samples from a linear regression model with the same unknown sparse $d$-dimensional vector of regression coefficients $\theta$. The goal of the fusion center is to estimate the vector $\theta$ and its support using few computations and limited communication at each machine. In this work, we consider distributed algorithms based on Orthogonal Matching Pursuit (OMP) and theoretically study their ability to exactly recover the support of $\theta$. We prove that under certain conditions, even at low signal-to-noise-ratios where individual machines are unable to detect the support of $\theta$, distributed-OMP methods correctly recover it with total communication sublinear in $d$. In addition, we present simulations that illustrate the performance of distributed OMP-based algorithms and show that they perform similarly to more sophisticated and computationally intensive methods, and in some cases even outperform them.  ( 2 min )

Traditional automated metrics for evaluating conditional natural language generation use pairwise comparisons between a single generated text and the best-matching gold-standard ground truth text. When multiple ground truths are available, scores are aggregated using an average or max operation across references. While this approach works well when diversity in the ground truth data (i.e. dispersion of the distribution of conditional texts) can be ascribed to noise, such as in automated speech recognition, it does not allow for robust evaluation in the case where diversity in the ground truths represents signal for the model. In this work we argue that existing metrics are not appropriate for domains such as visual description or summarization where ground truths are semantically diverse, and where the diversity in those captions captures useful additional information about the context. We propose a novel paradigm for multi-candidate evaluation of conditional language generation models, and a new family of metrics that compare the distributions of reference and model-generated caption sets using small sample sets of each. We demonstrate the utility of our approach with a case study in visual description: where we show that existing models optimize for single-description quality over diversity, and gain some insights into how sampling methods and temperature impact description quality and diversity.  ( 3 min )

Safe reinforcement learning (RL) studies problems where an intelligent agent has to not only maximize reward but also avoid exploring unsafe areas. In this study, we propose CUP, a novel policy optimization method based on Constrained Update Projection framework that enjoys rigorous safety guarantee. Central to our CUP development is the newly proposed surrogate functions along with the performance bound. Compared to previous safe RL methods, CUP enjoys the benefits of 1) CUP generalizes the surrogate functions to generalized advantage estimator (GAE), leading to strong empirical performance. 2) CUP unifies performance bounds, providing a better understanding and interpretability for some existing algorithms; 3) CUP provides a non-convex implementation via only first-order optimizers, which does not require any strong approximation on the convexity of the objectives. To validate our CUP method, we compared CUP against a comprehensive list of safe RL baselines on a wide range of tasks. Experiments show the effectiveness of CUP both in terms of reward and safety constraint satisfaction. We have opened the source code of CUP at https://github.com/RL-boxes/Safe-RL/tree/ main/CUP.  ( 2 min )

This paper presents COOL-MC, a tool that integrates state-of-the-art reinforcement learning (RL) and model checking. Specifically, the tool builds upon the OpenAI gym and the probabilistic model checker Storm. COOL-MC provides the following features: (1) a simulator to train RL policies in the OpenAI gym for Markov decision processes (MDPs) that are defined as input for Storm, (2) a new model builder for Storm, which uses callback functions to verify (neural network) RL policies, (3) formal abstractions that relate models and policies specified in OpenAI gym or Storm, and (4) algorithms to obtain bounds on the performance of so-called permissive policies. We describe the components and architecture of COOL-MC and demonstrate its features on multiple benchmark environments.  ( 2 min )

We study best-arm identification with a fixed budget and contextual (covariate) information in stochastic multi-armed bandit problems. In each round, after observing contextual information, we choose a treatment arm using past observations and current context. Our goal is to identify the best treatment arm, a treatment arm with the maximal expected reward marginalized over the contextual distribution, with a minimal probability of misidentification. First, we derive semiparametric lower bounds for this problem, where we regard the gaps between the expected rewards of the best and suboptimal treatment arms as parameters of interest, and all other parameters, such as the expected rewards conditioned on contexts, as the nuisance parameters. We then develop the "Contextual RS-AIPW strategy," which consists of the random sampling (RS) rule tracking a target allocation ratio and the recommendation rule using the augmented inverse probability weighting (AIPW) estimator. Our proposed Contextual RS-AIPW strategy is optimal because the upper bound for the probability of misidentification matches the semiparametric lower bound when the budget goes to infinity, and the gaps converge to zero.  ( 2 min )

We train graph neural networks on halo catalogues from Gadget N-body simulations to perform field-level likelihood-free inference of cosmological parameters. The catalogues contain $\lesssim$5,000 halos with masses $\gtrsim 10^{10}~h^{-1}M_\odot$ in a periodic volume of $(25~h^{-1}{\rm Mpc})^3$; every halo in the catalogue is characterized by several properties such as position, mass, velocity, concentration, and maximum circular velocity. Our models, built to be permutationally, translationally, and rotationally invariant, do not impose a minimum scale on which to extract information and are able to infer the values of $\Omega_{\rm m}$ and $\sigma_8$ with a mean relative error of $\sim6\%$, when using positions plus velocities and positions plus masses, respectively. More importantly, we find that our models are very robust: they can infer the value of $\Omega_{\rm m}$ and $\sigma_8$ when tested using halo catalogues from thousands of N-body simulations run with five different N-body codes: Abacus, CUBEP$^3$M, Enzo, PKDGrav3, and Ramses. Surprisingly, the model trained to infer $\Omega_{\rm m}$ also works when tested on thousands of state-of-the-art CAMELS hydrodynamic simulations run with four different codes and subgrid physics implementations. Using halo properties such as concentration and maximum circular velocity allow our models to extract more information, at the expense of breaking the robustness of the models. This may happen because the different N-body codes are not converged on the relevant scales corresponding to these parameters.  ( 3 min )

Much of the literature on optimal design of bandit algorithms is based on minimization of expected regret. It is well known that designs that are optimal over certain exponential families can achieve expected regret that grows logarithmically in the number of arm plays, at a rate governed by the Lai-Robbins lower bound. In this paper, we show that when one uses such optimized designs, the regret distribution of the associated algorithms necessarily has a very heavy tail, specifically, that of a truncated Cauchy distribution. Furthermore, for $p>1$, the $p$'th moment of the regret distribution grows much faster than poly-logarithmically, in particular as a power of the total number of arm plays. We show that optimized UCB bandit designs are also fragile in an additional sense, namely when the problem is even slightly mis-specified, the regret can grow much faster than the conventional theory suggests. Our arguments are based on standard change-of-measure ideas, and indicate that the most likely way that regret becomes larger than expected is when the optimal arm returns below-average rewards in the first few arm plays, thereby causing the algorithm to believe that the arm is sub-optimal. To alleviate the fragility issues exposed, we show that UCB algorithms can be modified so as to ensure a desired degree of robustness to mis-specification. In doing so, we also provide a sharp trade-off between the amount of UCB exploration and the tail exponent of the resulting regret distribution.

Topological data analysis (TDA) studies the shape patterns of data. Persistent homology is a widely used method in TDA that summarizes homological features of data at multiple scales and stores them in persistence diagrams (PDs). In this paper, we propose a random persistence diagram generator (RPDG) method that generates a sequence of random PDs from the ones produced by the data. RPDG is underpinned by a model based on pairwise interacting point processes, and a reversible jump Markov chain Monte Carlo (RJ-MCMC) algorithm. A first example, which is based on a synthetic dataset, demonstrates the efficacy of RPDG and provides a comparison with another method for sampling PDs. A second example demonstrates the utility of RPDG to solve a materials science problem given a real dataset of small sample size.

Clustering is an important exploratory data analysis technique to group objects based on their similarity. The widely used $K$-means clustering method relies on some notion of distance to partition data into a fewer number of groups. In the Euclidean space, centroid-based and distance-based formulations of the $K$-means are equivalent. In modern machine learning applications, data often arise as probability distributions and a natural generalization to handle measure-valued data is to use the optimal transport metric. Due to non-negative Alexandrov curvature of the Wasserstein space, barycenters suffer from regularity and non-robustness issues. The peculiar behaviors of Wasserstein barycenters may make the centroid-based formulation fail to represent the within-cluster data points, while the more direct distance-based $K$-means approach and its semidefinite program (SDP) relaxation are capable of recovering the true cluster labels. In the special case of clustering Gaussian distributions, we show that the SDP relaxed Wasserstein $K$-means can achieve exact recovery given the clusters are well-separated under the $2$-Wasserstein metric. Our simulation and real data examples also demonstrate that distance-based $K$-means can achieve better classification performance over the standard centroid-based $K$-means for clustering probability distributions and images.

We report on what seems to be an intriguing connection between variable integration time and partial velocity refreshment of Ideal Hamiltonian Monte Carlo samplers, both of which can be used for reducing the dissipative behavior of the dynamics. More concretely, we show that on quadratic potentials, efficiency can be improved through these means by a $\sqrt{\kappa}$ factor in Wasserstein-2 distance, compared to classical constant integration time, fully refreshed HMC.

Determining subgroups that respond especially well (or poorly) to specific interventions (medical or policy) requires new supervised learning methods tailored specifically for causal inference. Bayesian Causal Forest (BCF) is a recent method that has been documented to perform well on data generating processes with strong confounding of the sort that is plausible in many applications. This paper develops a novel algorithm for fitting the BCF model, which is more efficient than the previously available Gibbs sampler. The new algorithm can be used to initialize independent chains of the existing Gibbs sampler leading to better posterior exploration and coverage of the associated interval estimates in simulation studies. The new algorithm is compared to related approaches via simulation studies as well as an empirical analysis.

We propose a new sensitivity analysis model that combines copulas and normalizing flows for causal inference under unobserved confounding. We refer to the new model as $\rho$-GNF ($\rho$-Graphical Normalizing Flow), where $\rho{\in}[-1,+1]$ is a bounded sensitivity parameter representing the backdoor non-causal association due to unobserved confounding modeled using the most well studied and widely popular Gaussian copula. Specifically, $\rho$-GNF enables us to estimate and analyse the frontdoor causal effect or average causal effect (ACE) as a function of $\rho$. We call this the $\rho_{curve}$. The $\rho_{curve}$ enables us to specify the confounding strength required to nullify the ACE. We call this the $\rho_{value}$. Further, the $\rho_{curve}$ also enables us to provide bounds for the ACE given an interval of $\rho$ values. We illustrate the benefits of $\rho$-GNF with experiments on simulated and real-world data in terms of our empirical ACE bounds being narrower than other popular ACE bounds.

Point process models are of great importance in real world applications. In certain critical applications, estimation of point process models involves large amounts of sensitive personal data from users. Privacy concerns naturally arise which have not been addressed in the existing literature. To bridge this glaring gap, we propose the first general differentially private estimation procedure for point process models. Specifically, we take the Hawkes process as an example, and introduce a rigorous definition of differential privacy for event stream data based on a discretized representation of the Hawkes process. We then propose two differentially private optimization algorithms, which can efficiently estimate Hawkes process models with the desired privacy and utility guarantees under two different settings. Experiments are provided to back up our theoretical analysis.

In domains where sample sizes are limited, efficient learning algorithms are critical. Learning using privileged information (LuPI) offers increased sample efficiency by allowing prediction models access to types of information at training time which is unavailable when the models are used. In recent work, it was shown that for prediction in linear-Gaussian dynamical systems, a LuPI learner with access to intermediate time series data is never worse and often better in expectation than any unbiased classical learner. We provide new insights into this analysis and generalize it to nonlinear prediction tasks in latent dynamical systems, extending theoretical guarantees to the case where the map connecting latent variables and observations is known up to a linear transform. In addition, we propose algorithms based on random features and representation learning for the case when this map is unknown. A suite of empirical results confirm theoretical findings and show the potential of using privileged time-series information in nonlinear prediction.

We study differentially private (DP) stochastic optimization (SO) with data containing outliers and loss functions that are not Lipschitz continuous. To date, the vast majority of work on DP SO assumes that the loss is Lipschitz (i.e. stochastic gradients are uniformly bounded), and their error bounds scale with the Lipschitz parameter of the loss. While this assumption is convenient, it is often unrealistic: in many practical problems where privacy is required, data may contain outliers or be unbounded, causing some stochastic gradients to have large norm. In such cases, the Lipschitz parameter may be prohibitively large, leading to vacuous excess risk bounds. Thus, building on a recent line of work [WXDX20, KLZ22], we make the weaker assumption that stochastic gradients have bounded $k$-th moments for some $k \geq 2$. Compared with works on DP Lipschitz SO, our excess risk scales with the $k$-th moment bound instead of the Lipschitz parameter of the loss, allowing for significantly faster rates in the presence of outliers. For convex and strongly convex loss functions, we provide the first asymptotically optimal excess risk bounds (up to a logarithmic factor). Moreover, in contrast to the prior works [WXDX20, KLZ22], our bounds do not require the loss function to be differentiable/smooth. We also devise an accelerated algorithm that runs in linear time and yields improved (compared to prior works) and nearly optimal excess risk for smooth losses. Additionally, our work is the first to address non-convex non-Lipschitz loss functions satisfying the Proximal-PL inequality; this covers some classes of neural nets, among other practical models. Our Proximal-PL algorithm has nearly optimal excess risk that almost matches the strongly convex lower bound. Lastly, we provide shuffle DP variations of our algorithms, which do not require a trusted curator (e.g. for distributed learning).

Score-based divergences have been widely used in machine learning and statistics applications. Despite their empirical success, a blindness problem has been observed when using these for multi-modal distributions. In this work, we discuss the blindness problem and propose a new family of divergences that can mitigate the blindness problem. We illustrate our proposed divergence in the context of density estimation and report improved performance compared to traditional approaches.

NDCG, namely Normalized Discounted Cumulative Gain, is a widely used ranking metric in information retrieval and machine learning. However, efficient and provable stochastic methods for maximizing NDCG are still lacking, especially for deep models. In this paper, we propose a principled approach to optimize NDCG and its top-$K$ variant. First, we formulate a novel compositional optimization problem for optimizing the NDCG surrogate, and a novel bilevel compositional optimization problem for optimizing the top-$K$ NDCG surrogate. Then, we develop efficient stochastic algorithms with provable convergence guarantees for the non-convex objectives. Different from existing NDCG optimization methods, the per-iteration complexity of our algorithms scales with the mini-batch size instead of the number of total items. To improve the effectiveness for deep learning, we further propose practical strategies by using initial warm-up and stop gradient operator. Experimental results on multiple datasets demonstrate that our methods outperform prior ranking approaches in terms of NDCG. To the best of our knowledge, this is the first time that stochastic algorithms are proposed to optimize NDCG with a provable convergence guarantee. Our proposed methods are implemented in the LibAUC library at https://libauc.org/.

Neural Ordinary Differential Equations (Neural ODEs) are the continuous analog of Residual Neural Networks (ResNets). We investigate whether the discrete dynamics defined by a ResNet are close to the continuous one of a Neural ODE. We first quantify the distance between the ResNet's hidden state trajectory and the solution of its corresponding Neural ODE. Our bound is tight and, on the negative side, does not go to 0 with depth N if the residual functions are not smooth with depth. On the positive side, we show that this smoothness is preserved by gradient descent for a ResNet with linear residual functions and small enough initial loss. It ensures an implicit regularization towards a limit Neural ODE at rate 1 over N, uniformly with depth and optimization time. As a byproduct of our analysis, we consider the use of a memory-free discrete adjoint method to train a ResNet by recovering the activations on the fly through a backward pass of the network, and show that this method theoretically succeeds at large depth if the residual functions are Lipschitz with the input. We then show that Heun's method, a second order ODE integration scheme, allows for better gradient estimation with the adjoint method when the residual functions are smooth with depth. We experimentally validate that our adjoint method succeeds at large depth, and that Heun method needs fewer layers to succeed. We finally use the adjoint method successfully for fine-tuning very deep ResNets without memory consumption in the residual layers.

We study the problem of high-dimensional sparse linear regression in a distributed setting under both computational and communication constraints. Specifically, we consider a star topology network whereby several machines are connected to a fusion center, with whom they can exchange relatively short messages. Each machine holds noisy samples from a linear regression model with the same unknown sparse $d$-dimensional vector of regression coefficients $\theta$. The goal of the fusion center is to estimate the vector $\theta$ and its support using few computations and limited communication at each machine. In this work, we consider distributed algorithms based on Orthogonal Matching Pursuit (OMP) and theoretically study their ability to exactly recover the support of $\theta$. We prove that under certain conditions, even at low signal-to-noise-ratios where individual machines are unable to detect the support of $\theta$, distributed-OMP methods correctly recover it with total communication sublinear in $d$. In addition, we present simulations that illustrate the performance of distributed OMP-based algorithms and show that they perform similarly to more sophisticated and computationally intensive methods, and in some cases even outperform them.

Minimizing the inclusive Kullback-Leibler (KL) divergence with stochastic gradient descent (SGD) is challenging since its gradient is defined as an integral over the posterior. Recently, multiple methods have been proposed to run SGD with biased gradient estimates obtained from a Markov chain. This paper provides the first non-asymptotic convergence analysis of these methods by establishing their mixing rate and gradient variance. To do this, we demonstrate that these methods-which we collectively refer to as Markov chain score ascent (MCSA) methods-can be cast as special cases of the Markov chain gradient descent framework. Furthermore, by leveraging this new understanding, we develop a novel MCSA scheme, parallel MCSA (pMCSA), that achieves a tighter bound on the gradient variance. We demonstrate that this improved theoretical result translates to superior empirical performance.

We study the problem of average-reward Markov decision processes (AMDPs) and develop novel first-order methods with strong theoretical guarantees for both policy evaluation and optimization. Existing on-policy evaluation methods suffer from sub-optimal convergence rates as well as failure in handling insufficiently random policies, e.g., deterministic policies, for lack of exploration. To remedy these issues, we develop a novel variance-reduced temporal difference (VRTD) method with linear function approximation for randomized policies along with sharp convergence guarantees, and an exploratory variance-reduced temporal difference (EVRTD) method for insufficiently random policies with comparable convergence guarantees. We further establish linear convergence rate on the bias of policy evaluation, which is essential for improving the overall sample complexity of policy optimization. On the other hand, compared with intensive research interest in finite sample analysis of policy gradient methods for discounted MDPs, existing studies on policy gradient methods for AMDPs mostly focus on regret bounds under restrictive assumptions on the underlying Markov processes (see, e.g., Abbasi-Yadkori et al., 2019), and they often lack guarantees on the overall sample complexities. Towards this end, we develop an average-reward variant of the stochastic policy mirror descent (SPMD) (Lan, 2022). We establish the first $\widetilde{\mathcal{O}}(\epsilon^{-2})$ sample complexity for solving AMDPs with policy gradient method under both the generative model (with unichain assumption) and Markovian noise model (with ergodic assumption). This bound can be further improved to $\widetilde{\mathcal{O}}(\epsilon^{-1})$ for solving regularized AMDPs. Our theoretical advantages are corroborated by numerical experiments.

The matching principles behind optimal transport (OT) play an increasingly important role in machine learning, a trend which can be observed when OT is used to disambiguate datasets in applications (e.g. single-cell genomics) or used to improve more complex methods (e.g. balanced attention in transformers or self-supervised learning). To scale to more challenging problems, there is a growing consensus that OT requires solvers that can operate on millions, not thousands, of points. The low-rank optimal transport (LOT) approach advocated in \cite{scetbon2021lowrank} holds several promises in that regard, and was shown to complement more established entropic regularization approaches, being able to insert itself in more complex pipelines, such as quadratic OT. LOT restricts the search for low-cost couplings to those that have a low-nonnegative rank, yielding linear time algorithms in cases of interest. However, these promises can only be fulfilled if the LOT approach is seen as a legitimate contender to entropic regularization when compared on properties of interest, where the scorecard typically includes theoretical properties (statistical complexity and relation to other methods) or practical aspects (debiasing, hyperparameter tuning, initialization). We target each of these areas in this paper in order to cement the impact of low-rank approaches in computational OT.

This paper proposes a family of network centralities called fixed-point centralities. This centrality family is defined via the fixed point of permutation equivariant mappings related to the underlying network. Such a centrality notion is immediately extended to define fixed-point centralities for infinite graphs characterized by graphons. Variation bounds of such centralities with respect to the variations of the underlying graphs and graphons under mild assumptions are established. Fixed-point centralities connect with a variety of different models on networks including graph neural networks, static and dynamic games on networks, and Markov decision processes.

We establish the first nonasymptotic error bounds for Kaplan-Meier-based nearest neighbor and kernel survival probability estimators where feature vectors reside in metric spaces. Our bounds imply rates of strong consistency for these nonparametric estimators and, up to a log factor, match an existing lower bound for conditional CDF estimation. Our proof strategy also yields nonasymptotic guarantees for nearest neighbor and kernel variants of the Nelson-Aalen cumulative hazards estimator. We experimentally compare these methods on four datasets. We find that for the kernel survival estimator, a good choice of kernel is one learned using random survival forests.

Identification of linear time-invariant (LTI) systems plays an important role in control and reinforcement learning. Both asymptotic and finite-time offline system identification are well-studied in the literature. For online system identification, the idea of stochastic-gradient descent with reverse experience replay (SGD-RER) was recently proposed, where the data sequence is stored in several buffers and the stochastic-gradient descent (SGD) update performs backward in each buffer to break the time dependency between data points. Inspired by this work, we study distributed online system identification of LTI systems over a multi-agent network. We consider agents as identical LTI systems, and the network goal is to jointly estimate the system parameters by leveraging the communication between agents. We propose DSGD-RER, a distributed variant of the SGD-RER algorithm, and theoretically characterize the improvement of the estimation error with respect to the network size. Our numerical experiments certify the reduction of estimation error as the network size grows.

The Natarajan dimension is a fundamental tool for characterizing multi-class PAC learnability, generalizing the Vapnik-Chervonenkis (VC) dimension from binary to multi-class classification problems. This note establishes upper bounds on Natarajan dimensions for certain function classes, including (i) multi-class decision tree and random forests, and (ii) multi-class neural networks with binary, linear and ReLU activations. These results may be relevant for describing the performance of certain multi-class learning algorithms.

The iterative weight update for the AdaBoost machine learning algorithm may be realized as a dynamical map on a probability simplex. When learning a low-dimensional data set this algorithm has a tendency towards cycling behavior, which is the topic of this paper. AdaBoost's cycling behavior lends itself to direct computational methods that are ineffective in the general, non-cycling case of the algorithm. From these computational properties we give a concrete correspondence between AdaBoost's cycling behavior and continued fractions dynamics. Then we explore the results of this correspondence to expound on how the algorithm comes to be in this periodic state at all. What we intend for this work is to be a novel and self-contained explanation for the cycling dynamics of this machine learning algorithm.

Markov chain Monte Carlo (MCMC), such as Langevin dynamics, is valid for approximating intractable distributions. However, its usage is limited in the context of deep latent variable models owing to costly datapoint-wise sampling iterations and slow convergence. This paper proposes the amortized Langevin dynamics (ALD), wherein datapoint-wise MCMC iterations are entirely replaced with updates of an encoder that maps observations into latent variables. This amortization enables efficient posterior sampling without datapoint-wise iterations. Despite its efficiency, we prove that ALD is valid as an MCMC algorithm, whose Markov chain has the target posterior as a stationary distribution under mild assumptions. Based on the ALD, we also present a new deep latent variable model named the Langevin autoencoder (LAE). Interestingly, the LAE can be implemented by slightly modifying the traditional autoencoder. Using multiple synthetic datasets, we first validate that ALD can properly obtain samples from target posteriors. We also evaluate the LAE on the image generation task, and show that our LAE can outperform existing methods based on variational inference, such as the variational autoencoder, and other MCMC-based methods in terms of the test likelihood.

Distributional shift, or the mismatch between training and deployment data, is a significant obstacle to the usage of machine learning in high-stakes industrial applications, such as autonomous driving and medicine. This creates a need to be able to assess how robustly ML models generalize as well as the quality of their uncertainty estimates. Standard ML baseline datasets do not allow these properties to be assessed, as the training, validation and test data are often identically distributed. Recently, a range of dedicated benchmarks have appeared, featuring both distributionally matched and shifted data. Among these benchmarks, the Shifts dataset stands out in terms of the diversity of tasks as well as the data modalities it features. While most of the benchmarks are heavily dominated by 2D image classification tasks, Shifts contains tabular weather forecasting, machine translation, and vehicle motion prediction tasks. This enables the robustness properties of models to be assessed on a diverse set of industrial-scale tasks and either universal or directly applicable task-specific conclusions to be reached. In this paper, we extend the Shifts Dataset with two datasets sourced from industrial, high-risk applications of high societal importance. Specifically, we consider the tasks of segmentation of white matter Multiple Sclerosis lesions in 3D magnetic resonance brain images and the estimation of power consumption in marine cargo vessels. Both tasks feature ubiquitous distributional shifts and a strict safety requirement due to the high cost of errors. These new datasets will allow researchers to further explore robust generalization and uncertainty estimation in new situations. In this work, we provide a description of the dataset and baseline results for both tasks.

Diffusion models are a new class of generative models that mark a milestone in high-quality image generation while relying on solid probabilistic principles. This makes them promising candidate models for neural image compression. This paper outlines an end-to-end optimized framework based on a conditional diffusion model for image compression. Besides latent variables inherent to the diffusion process, the model introduces an additional per-instance "content" latent variable to condition the denoising process. Upon decoding, the diffusion process conditionally generates/reconstructs an image using ancestral sampling. Our experiments show that this approach outperforms one of the best-performing conventional image codecs (BPG) and one neural codec on two compression benchmarks, where we focus on rate-perception tradeoffs. Qualitatively, our approach shows fewer decompression artifacts than the classical approach.

This paper presents a statistical model for stationary ergodic point processes, estimated from a single realization observed in a square window. With existing approaches in stochastic geometry, it is very difficult to model processes with complex geometries formed by a large number of particles. Inspired by recent works on gradient descent algorithms for sampling maximum-entropy models, we describe a model that allows for fast sampling of new configurations reproducing the statistics of the given observation. Starting from an initial random configuration, its particles are moved according to the gradient of an energy, in order to match a set of prescribed moments (functionals). Our moments are defined via a phase harmonic operator on the wavelet transform of point patterns. They allow one to capture multi-scale interactions between the particles, while controlling explicitly the number of moments by the scales of the structures to model. We present numerical experiments on point processes with various geometric structures, and assess the quality of the model by spectral and topological data analysis.

This paper introduces a new interpretation of the Variational Autoencoder framework by taking a fully geometric point of view. We argue that vanilla VAE models unveil naturally a Riemannian structure in their latent space and that taking into consideration those geometrical aspects can lead to better interpolations and an improved generation procedure. This new proposed sampling method consists in sampling from the uniform distribution deriving intrinsically from the learned Riemannian latent space and we show that using this scheme can make a vanilla VAE competitive and even better than more advanced versions on several benchmark datasets. Since generative models are known to be sensitive to the number of training samples we also stress the method's robustness in the low data regime.

We consider the filtering and prediction problem for a diffusion process. The signal and observation are modeled by stochastic differential equations (SDEs) driven by correlated Wiener processes. In classical estimation theory, measure-valued stochastic partial differential equations (SPDEs) are derived for the filtering and prediction measures. These equations can be hard to solve numerically. We provide an approximation algorithm using conditional generative adversarial networks (GANs) in combination with signatures, an object from rough path theory. The signature of a sufficiently smooth path determines the path completely. As a result, in some cases, GANs based on signatures have been shown to efficiently approximate the law of a stochastic process. For our algorithm we extend this method to sample from the conditional law, given noisy, partial observation. Our generator is constructed using neural differential equations (NDEs), relying on their universal approximator property. We show well-posedness in providing a rigorous mathematical framework. Numerical results show the efficiency of our algorithm.

This paper investigates the post-hoc calibration of confidence for "exploratory" machine learning classification problems. The difficulty in these problems stems from the continuing desire to push the boundaries of which categories have enough examples to generalize from when curating datasets, and confusion regarding the validity of those categories. We argue that for such problems the "one-versus-all" approach (top-label calibration) must be used rather than the "calibrate-the-full-response-matrix" approach advocated elsewhere in the literature. We introduce and test four new algorithms designed to handle the idiosyncrasies of category-specific confidence estimation. Chief among these methods is the use of kernel density ratios for confidence calibration including a novel, bulletproof algorithm for choosing the bandwidth. We test our claims and explore the limits of calibration on a bioinformatics application (PhANNs) as well as the classic MNIST benchmark. Finally, our analysis argues that post-hoc calibration should always be performed, should be based only on the test dataset, and should be sanity-checked visually.

This paper is concerned with the sample efficiency of reinforcement learning, assuming access to a generative model (or simulator). We first consider $\gamma$-discounted infinite-horizon Markov decision processes (MDPs) with state space $\mathcal{S}$ and action space $\mathcal{A}$. Despite a number of prior works tackling this problem, a complete picture of the trade-offs between sample complexity and statistical accuracy is yet to be determined. In particular, all prior results suffer from a severe sample size barrier, in the sense that their claimed statistical guarantees hold only when the sample size exceeds at least $\frac{|\mathcal{S}||\mathcal{A}|}{(1-\gamma)^2}$. The current paper overcomes this barrier by certifying the minimax optimality of two algorithms -- a perturbed model-based algorithm and a conservative model-based algorithm -- as soon as the sample size exceeds the order of $\frac{|\mathcal{S}||\mathcal{A}|}{1-\gamma}$ (modulo some log factor). Moving beyond infinite-horizon MDPs, we further study time-inhomogeneous finite-horizon MDPs, and prove that a plain model-based planning algorithm suffices to achieve minimax-optimal sample complexity given any target accuracy level. To the best of our knowledge, this work delivers the first minimax-optimal guarantees that accommodate the entire range of sample sizes (beyond which finding a meaningful policy is information theoretically infeasible).

Transient phenomena play a key role in coordinating brain activity at multiple scales, however,their underlying mechanisms remain largely unknown. A key challenge for neural data science is thus to characterize the network interactions at play during these events. Using the formalism of Structural Causal Models and their graphical representation, we investigate the theoretical and empirical properties of Information Theory based causal strength measures in the context of recurring spontaneous transient events. After showing the limitations of Transfer Entropy and Dynamic Causal Strength in such a setting, we introduce a novel measure, relative Dynamic Causal Strength, and provide theoretical and empirical support for its benefits. These methods are applied to simulated and experimentally recorded neural time series, and provide results in agreement with our current understanding of the underlying brain circuits.

This work provides the first theoretical study on the ability of graph Message Passing Neural Networks (gMPNNs) -- such as Graph Neural Networks (GNNs) -- to achieve counterfactually-invariant representations for inductive out-of-distribution (OOD) link prediction tasks, where deployment (test) graph sizes are larger than training graphs. We first prove non-asymptotic bounds showing that link predictors based on permutation-equivariant (structural) node embeddings obtained by gMPNNs can converge to a random guess as test graphs get larger. We then propose a theoretically-sound gMPNN that outputs structural pairwise (2-node) embeddings and prove non-asymptotic bounds showing that, as test graphs grow, these embeddings converge to embeddings of a continuous function that retains its ability to predict links OOD. Empirical results on random graphs show agreement with our theoretical results.

The widespread adoption of deep neural networks in computer vision applications has brought forth a significant interest in adversarial robustness. Existing research has shown that maliciously perturbed inputs specifically tailored for a given model (i.e., adversarial examples) can be successfully transferred to another independently trained model to induce prediction errors. Moreover, this property of adversarial examples has been attributed to features derived from predictive patterns in the data distribution. Thus, we are motivated to investigate the following question: Can adversarial defenses, like adversarial examples, be successfully transferred to other independently trained models? To this end, we propose a deep learning-based pre-processing mechanism, which we refer to as a robust transferable feature extractor (RTFE). After examining theoretical motivation and implications, we experimentally show that our method can provide adversarial robustness to multiple independently pre-trained classifiers that are otherwise ineffective against an adaptive white box adversary. Furthermore, we show that RTFEs can even provide one-shot adversarial robustness to models independently trained on different datasets.

Generative Adversarial Networks (GANs) have achieved great success in data generation. However, its statistical properties are not fully understood. In this paper, we consider the statistical behavior of the general $f$-divergence formulation of GAN, which includes the Kullback--Leibler divergence that is closely related to the maximum likelihood principle. We show that for parametric generative models that are correctly specified, all $f$-divergence GANs with the same discriminator classes are asymptotically equivalent under suitable regularity conditions. Moreover, with an appropriately chosen local discriminator, they become equivalent to the maximum likelihood estimate asymptotically. For generative models that are misspecified, GANs with different $f$-divergences {converge to different estimators}, and thus cannot be directly compared. However, it is shown that for some commonly used $f$-divergences, the original $f$-GAN is not optimal in that one can achieve a smaller asymptotic variance when the discriminator training in the original $f$-GAN formulation is replaced by logistic regression. The resulting estimation method is referred to as Adversarial Gradient Estimation (AGE). Empirical studies are provided to support the theory and to demonstrate the advantage of AGE over the original $f$-GANs under model misspecification.  ( 2 min )

Stochastic kriging has been widely employed for simulation metamodeling to predict the response surface of complex simulation models. However, its use is limited to cases where the design space is low-dimensional because, in general, the sample complexity (i.e., the number of design points required for stochastic kriging to produce an accurate prediction) grows exponentially in the dimensionality of the design space. The large sample size results in both a prohibitive sample cost for running the simulation model and a severe computational challenge due to the need to invert large covariance matrices. Based on tensor Markov kernels and sparse grid experimental designs, we develop a novel methodology that dramatically alleviates the curse of dimensionality. We show that the sample complexity of the proposed methodology grows only slightly in the dimensionality, even under model misspecification. We also develop fast algorithms that compute stochastic kriging in its exact form without any approximation schemes. We demonstrate via extensive numerical experiments that our methodology can handle problems with a design space of more than 10,000 dimensions, improving both prediction accuracy and computational efficiency by orders of magnitude relative to typical alternative methods in practice.  ( 3 min )

This paper describes an approach for fitting an immersed submanifold of a finite-dimensional Euclidean space to random samples. The reconstruction mapping from the ambient space to the desired submanifold is implemented as a composition of an encoder that maps each point to a tuple of (positive or negative) times and a decoder given by a composition of flows along finitely many vector fields starting from a fixed initial point. The encoder supplies the times for the flows. The encoder-decoder map is obtained by empirical risk minimization, and a high-probability bound is given on the excess risk relative to the minimum expected reconstruction error over a given class of encoder-decoder maps. The proposed approach makes fundamental use of Sussmann's orbit theorem, which guarantees that the image of the reconstruction map is indeed contained in an immersed submanifold.  ( 2 min )

We propose a novel contextual bandit algorithm for generalized linear rewards with an $\tilde{O}(\sqrt{\kappa^{-1} \phi T})$ regret over $T$ rounds where $\phi$ is the minimum eigenvalue of the covariance of contexts and $\kappa$ is a lower bound of the variance of rewards. In several practical cases where $\phi=O(d)$, our result is the first regret bound for generalized linear model (GLM) bandits with the order $\sqrt{d}$ without relying on the approach of Auer [2002]. We achieve this bound using a novel estimator called double doubly-robust (DDR) estimator, a subclass of doubly-robust (DR) estimator but with a tighter error bound. The approach of Auer [2002] achieves independence by discarding the observed rewards, whereas our algorithm achieves independence considering all contexts using our DDR estimator. We also provide an $O(\kappa^{-1} \phi \log (NT) \log T)$ regret bound for $N$ arms under a probabilistic margin condition. Regret bounds under the margin condition are given by Bastani and Bayati [2020] and Bastani et al. [2021] under the setting that contexts are common to all arms but coefficients are arm-specific. When contexts are different for all arms but coefficients are common, ours is the first regret bound under the margin condition for linear models or GLMs. We conduct empirical studies using synthetic data and real examples, demonstrating the effectiveness of our algorithm.  ( 3 min )

In recent years, deep learning has been a topic of interest in almost all disciplines due to its impressive empirical success in analyzing complex data sets, such as imaging, genetics, climate, and medical data. While most of the developments are treated as black-box machines, there is an increasing interest in interpretable, reliable, and robust deep learning models applicable to a broad class of applications. Feature-selected deep learning is proven to be promising in this regard. However, the recent developments do not address the situations of ultra-high dimensional and highly correlated feature selection in addition to the high noise level. In this article, we propose a novel screening and cleaning strategy with the aid of deep learning for the cluster-level discovery of highly correlated predictors with a controlled error rate. A thorough empirical evaluation over a wide range of simulated scenarios demonstrates the effectiveness of the proposed method by achieving high power while having a minimal number of false discoveries. Furthermore, we implemented the algorithm in the riboflavin (vitamin $B_2$) production dataset in the context of understanding the possible genetic association with riboflavin production. The gain of the proposed methodology is illustrated by achieving lower prediction error compared to other state-of-the-art methods.  ( 2 min )

We present a minimax optimal learner for the problem of learning predictors robust to adversarial examples at test-time. Interestingly, we find that this requires new algorithmic ideas and approaches to adversarially robust learning. In particular, we show, in a strong negative sense, the suboptimality of the robust learner proposed by Montasser, Hanneke, and Srebro (2019) and a broader family of learners we identify as local learners. Our results are enabled by adopting a global perspective, specifically, through a key technical contribution: the global one-inclusion graph, which may be of independent interest, that generalizes the classical one-inclusion graph due to Haussler, Littlestone, and Warmuth (1994). Finally, as a byproduct, we identify a dimension characterizing qualitatively and quantitatively what classes of predictors $\mathcal{H}$ are robustly learnable. This resolves an open problem due to Montasser et al. (2019), and closes a (potentially) infinite gap between the established upper and lower bounds on the sample complexity of adversarially robust learning.  ( 2 min )

We consider the problem of estimating the skeleton of a large causal polytree from a relatively small i.i.d. sample. This is motivated by the problem of determining causal structure when the number of variables is very large compared to the sample size, such as in gene regulatory networks. We give an algorithm that recovers the tree with high accuracy in such settings. The algorithm works under essentially no distributional or modeling assumptions other than some mild non-degeneracy conditions.  ( 2 min )

We consider observations $(X,y)$ from single index models with unknown link function, Gaussian covariates and a regularized M-estimator $\hat\beta$ constructed from convex loss function and regularizer. In the regime where sample size $n$ and dimension $p$ are both increasing such that $p/n$ has a finite limit, the behavior of the empirical distribution of $\hat\beta$ and the predicted values $X\hat\beta$ has been previously characterized in a number of models: The empirical distributions are known to converge to proximal operators of the loss and penalty in a related Gaussian sequence model, which captures the interplay between ratio $p/n$, loss, regularization and the data generating process. This connection between$(\hat\beta,X\hat\beta)$ and the corresponding proximal operators require solving fixed-point equations that typically involve unobservable quantities such as the prior distribution on the index or the link function. This paper develops a different theory to describe the empirical distribution of $\hat\beta$ and $X\hat\beta$: Approximations of $(\hat\beta,X\hat\beta)$ in terms of proximal operators are provided that only involve observable adjustments. These proposed observable adjustments are data-driven, e.g., do not require prior knowledge of the index or the link function. These new adjustments yield confidence intervals for individual components of the index, as well as estimators of the correlation of $\hat\beta$ with the index. The interplay between loss, regularization and the model is thus captured in a data-driven manner, without solving the fixed-point equations studied in previous works. The results apply to both strongly convex regularizers and unregularized M-estimation. Simulations are provided for the square and logistic loss in single index models including logistic regression and 1-bit compressed sensing with 20\% corrupted bits.  ( 3 min )

Treatment decisions in cancer care are guided by treatment effect estimates from randomized controlled trials (RCTs). RCTs estimate the average effect of one treatment versus another in a certain population. However, treatments may not be equally effective for every patient in a population. Knowing the effectiveness of treatments tailored to specific patient and tumor characteristics would enable individualized treatment decisions. Getting tailored treatment effects by averaging outcomes in different patient subgroups in RCTs requires an unfeasible number of patients to have sufficient statistical power in all relevant subgroups for all possible treatments. The American Joint Committee on Cancer (AJCC) recommends that researchers develop outcome prediction models (OPMs) in an effort to individualize treatment decisions. OPMs sometimes called risk models or prognosis models, use patient and tumor characteristics to predict a patient outcome such as overall survival. The assumption is that the predictions are useful for treatment decisions using rules such as "prescribe chemotherapy only if the OPM predicts the patient has a high risk of recurrence". Recognizing the importance of reliable predictions, the AJCC published a checklist for OPMs to ensure dependable OPM prediction accuracy in the patient population for which the OPM was designed. However, accurate outcome predictions do not imply that these predictions yield good treatment decisions. In this perspective, we show that OPM rely on a fixed treatment policy which implies that OPM that were found to accurately predict outcomes in validation studies can still lead to patient harm when used to inform treatment decisions. We then give guidance on how to develop models that are useful for individualized treatment decisions and how to evaluate whether a model has value for decision-making.  ( 3 min )

The rapid advancement of models based on artificial intelligence demands innovative monitoring techniques which can operate in real time with low computational costs. In machine learning, especially if we consider neural network (NN) learning algorithms, and in particular deep-learning architectures, the models are often trained in a supervised manner. Consequently, the learned relationship between the input and the output must remain valid during the model's deployment. If this stationarity assumption holds, we can conclude that the NN generates accurate predictions. Otherwise, the retraining or rebuilding of the model is required. We propose to consider the latent feature representation of the data (called "embedding") generated by the NN for determining the time point when the data stream starts being nonstationary. To be precise, we monitor embeddings by applying multivariate control charts based on the calculation of the data depth and normalized ranks. The performance of the introduced method is evaluated using various NNs with different underlying data formats.  ( 2 min )

In decision-making problems such as the multi-armed bandit, an agent learns sequentially by optimizing a certain feedback. While the mean reward criterion has been extensively studied, other measures that reflect an aversion to adverse outcomes, such as mean-variance or conditional value-at-risk (CVaR), can be of interest for critical applications (healthcare, agriculture). Algorithms have been proposed for such risk-aware measures under bandit feedback without contextual information. In this work, we study contextual bandits where such risk measures can be elicited as linear functions of the contexts through the minimization of a convex loss. A typical example that fits within this framework is the expectile measure, which is obtained as the solution of an asymmetric least-square problem. Using the method of mixtures for supermartingales, we derive confidence sequences for the estimation of such risk measures. We then propose an optimistic UCB algorithm to learn optimal risk-aware actions, with regret guarantees similar to those of generalized linear bandits. This approach requires solving a convex problem at each round of the algorithm, which we can relax by allowing only approximated solution obtained by online gradient descent, at the cost of slightly higher regret. We conclude by evaluating the resulting algorithms on numerical experiments.  ( 2 min )

We study best-arm identification with a fixed budget and contextual (covariate) information in stochastic multi-armed bandit problems. In each round, after observing contextual information, we choose a treatment arm using past observations and current context. Our goal is to identify the best treatment arm, a treatment arm with the maximal expected reward marginalized over the contextual distribution, with a minimal probability of misidentification. First, we derive semiparametric lower bounds for this problem, where we regard the gaps between the expected rewards of the best and suboptimal treatment arms as parameters of interest, and all other parameters, such as the expected rewards conditioned on contexts, as the nuisance parameters. We then develop the "Contextual RS-AIPW strategy," which consists of the random sampling (RS) rule tracking a target allocation ratio and the recommendation rule using the augmented inverse probability weighting (AIPW) estimator. Our proposed Contextual RS-AIPW strategy is optimal because the upper bound for the probability of misidentification matches the semiparametric lower bound when the budget goes to infinity, and the gaps converge to zero.  ( 2 min )

One thing I noticed with facial performance transfer networks is often the reenactment tends to poorly imitate the mouth movements of the source actor. The overall shape is preserved fairly well, but subtle "visemes" (visual analog of "phonemes") like those produced when pronouncing consonants seem to regress to the mean. In 2016, a project called LipNet (https://www.youtube.com/watch?v=wg3upHE8qJw) had shown impressive results in predicting dialogue from viseme inputs only (no audio inputs). Therefore, perhaps a similar network could be used to produce a loss term when training a facial reenactment network: If the lip-reading predictions of the input and output are more similar, the loss is lower. (A possible design for this classification network could be something similar to CLIP: Given a text transcript converted to the phonetic alphabet, and a short video sequence cropped to the mouth region, the classifier is trained using contrastive learning to pair the two, using the dot product between their two vectors to judge similarity. Then after the network is trained, two input video sequences can be compared with or without a text transcript.) Has something like this been attempted already? If so, does it improve the results? Thanks for your attention! submitted by /u/zergling103 [link] [comments]  ( 90 min )

A new open source CLIP model was released at LAION. Very interesting results. This will probably power next iterations of stable diffusion. https://laion.ai/blog/large-openclip/ submitted by /u/nightshadew [link] [comments]  ( 88 min )

Hello, I want to make a think tank that goes beyond what think tanks are usually known for. An organization that cumulatively resolves the problems of society through innovation and the active fostering of it. Moving past my lofty goals of delusional grandeur what I do have as of now is an established company; I.S.P.A. Industries, and a website that has basic descriptions of some of the ideas I have more thought out/ designed in my head. I'm hoping to find people who want to look over what I have, help me develop it, and to get the same courtesy in return. We currently have 3 people involved and are looking to add a few more people to the core group who will have ownership rights to the company. IF you ever had that spark of genius for a design, program, invention, etc. but then lost it because it was a bit beyond your reach in making then we are the group for you. I know I have struggled with the various barriers that feed into that issue myself for as long as I can remember and intend to bring down those barriers. I want to make a company that solves that issue by directly providing in house services to get ideas made and out into the market without the extortionary price tag that some company's that provide similar services require to even start the process. I plan to do so by making the products this company makes from it's various members the main source of revenue so that we can foster new inventors and bring their respective products into the cumulative fold. This whole idea is based on the idea that we can bring many people, from all walks of life together and then pool our cumulative resources to make some initial products. If we can manage that then we can grow from there. With that in mind feel free to DM me, leave a comment, or maybe share this post with someone you think might be interested. Let's bring our innovative talents together and do something big. submitted by /u/38931841Hz [link] [comments]  ( 90 min )

Does anyone know of any glossolalia data sets? Or perhaps papers that use modern speech models to study glossolalia? I couldn't find anything on Google Scholar but it might just be too niche a topic. Or maybe I'm using the wrong terms. submitted by /u/carmichael561 [link] [comments]  ( 88 min )

I remember asking a while ago whether it makes sense to run neural nets in an architecture more resembling biological brain, and apparently there are efforts to accomplish exactly that: https://www.fz-juelich.de/en/news/archive/feature-stories/faster-than-the-biological-model In particular, this architecture allows to circumvent von Neumann bottleneck, which is manifested in latencies due to separation of memory and processing units in the classical computer architecture, thus resembling human brain more closely. submitted by /u/stockabuse [link] [comments]  ( 98 min )

Hey. I am new to the field. However I need a model that could do instance segmentation. At least label person, dog and cat at the image. Also I need to somehow convert it to use on iOS. Could someone please suggest some models that could possibly fit? Thanks in advance! submitted by /u/anokmik [link] [comments]  ( 89 min )

Transformers are designed to work well with natural languages and sequences where order matters. Positional encoding is used to take relative order of a token in a sequence. Is there a way to use it on a set of strings to test if the strings have similar meaning or coherence in general. Example {"Border Collie", "Doberman", "Pug"} should be classified as positive since all of them belong to the same category. {"Mango", "Cat", "some gibberish string", "Another GiBBerish STring", "treees"} should be classified as negative because there is the set is incoherent. In these kind of datasets, the relative order matters for individual elements, but on the whole order doesn't matter. Concretely, {"Border Collie", "Doberman", "Pug"} and {"Pug", "Border Collie", "Doberman"} should map to the same class(positive ); {"obrdr doliye", "mandober", "Pug"} should be classified as negative because the extra characters in the first element and shuffling of characters in the second element results in the loss of meaning and the set as a whole is incoherent. Is there a way to get transformer model to work on these kind of inputs? submitted by /u/legitimate-coffer [link] [comments]  ( 91 min )

Hello, We are accepting short (4+n) or long paper (8+n) contributions to our workshop, "Behavior-driven Autonomous Driving in Unstructured Environments (BADUE22)", to be held at IROS 2022 in Kyoto, Japan on 27th October 2022. We encourage the submission of early ideas, late-breaking results, position papers, or open research questions that are likely to generate interesting discussions. Work published elsewhere is allowed. Accepted papers will be presented in a poster session and selected papers as spotlight talks. All submitted contributions will go through a single blind review process. Deadline: Sept. 20, 2022 (AoE). Website: https://gamma.umd.edu/workshops/badue22/ Submit: https://cmt3.research.microsoft.com/BADUE2022/Submission/Index/ Contact organizer via email: rchandra@utexas.…  ( 92 min )

Hi r/ML, I have an RL setup where an episode involves training a NN and obtaining performance. And since I want to use batches of episodes to make updates using Policy Gradient, I'm wondering if there is a simple codebase which allows me to train NNs in parallel with no communication (no grad averaging and splitting data as in DDP) submitted by /u/selfsupervisedbot [link] [comments]  ( 90 min )

I'm currently using AdamW and find that an exponential decay schedule gives far better results than a fixed learning rate. I've used optuna to do bayesian optimization of my hyper-parameters including learning rate schedule and I just choose 300 epochs so trials would complete in a reasonable amount of time. However, I can train the winner above 1000 epochs and the validation loss continues to drop (around 1700 it starts to overfit). I imagine if I did another search over learning rate schedules using 2000 epochs that I'd get a different schedule and that would continue to do better if trained even longer as well. With Optuna, I stopped using pruners (like asynchronous successive halving) because I don't think the validation loss early in the training process says much about the final performance, and instead would be biased towards schedules with fast decays. So how do these projects that commit to a model and train it for days or weeks choose a schedule that isn't going to be 100x to cautious or end up overfitting 20% into their training budget? I'd imagine there's a method for dynamically adjusting the learning rate based on generalization error and the derivative of validation loss. I.E. if it starts overfitting then bump up the learning rate to get out of that local minimum and try to settle into a new one. But I haven't found any papers in that direction. submitted by /u/elbiot [link] [comments]  ( 93 min )

When we take a pre-trained network, e.g., ResNet50 on ImageNet, and want to apply it to a new dataset, what we typically do is: Freeze the backbone, but keep the classifier trainable Train until convergence Unfreeze the backbone and train with a low learning rate until convergence However, I noticed that when we freeze a network with batch normalization layers, the following parameters are still being updated because the batch normalization layers are in training mode: running_mean, running_var, num_batches_tracked (in PyTorch). I think this is okay, because this means that the pre-trained network's normalization statistics are adapting to the new data which may have a different distribution. If I understand correctly, this is what we want. We want the batch normalization statistics to be updated to the new distribution of the new dataset. If we kept the old statistics from the old dataset, our normalization might fail to produce actually normal outputs. I just want to check if this is a correct interpretation. submitted by /u/RaptorDotCpp [link] [comments]  ( 107 min )

I would like to make a point in an upcoming paper that was inspired by a blog post critiquing earlier work. Philosophically it is correct to cite the blog post but I am worried that reviewers would consider this a red flag even though the thought only exists in blog form. Is this correct? Another option would be to acknowledge the blog post author for helpful discussions if/when the paper is accepted. submitted by /u/Swimming-Pool397 [link] [comments]  ( 94 min )

Hi folks, stylepoint here. I have uploaded some new videos and posting the news here - maybe people find them helpful (: Also, some folks who have not seen the previous post might discover this one (: New vids: AI/ML Model API Design and Numerical Stability (follow-up) Implement - Linear Regression The first one is a follow-up video I have decided to upload in order to make things clear and update some of our model implementations. I made some further changes based on your and others' feedback and suggestions: All of the videos on the channel have timestamps now! (so you can skip chapters or just skim over the vids). I have increased the font size of the terminal so hoping the code is a lot more readable now. Increased the volume for the new video (should be better moving …  ( 91 min )

SpaceRobotEnv is an open-sourced environments for trajectory planning of free-floating space robots. Reaching high-level planning accuracy, bimanual coordination and end-to-end control remains an open challenge for space robotics researchers. To better help the community study this problem, SpaceRobotEnv are developed with the following key features: Real Space Environment; Dynamic coupling control; Image input. URL: https://github.com/Tsinghua-Space-Robot-Learning-Group/SpaceRobotEnv. Note: our repo can be found in the OpenAI Gym Documentation now. Please see SpaceRobotEnv. Hope everyone enjoy it! https://reddit.com/link/xek9im/video/0migj29dlxn91/player submitted by /u/Shengjie_Wang [link] [comments]  ( 103 min )

https://transformer-circuits.pub/2022/toy_model/index.html It would be very convenient if the individual neurons of artificial neural networks corresponded to cleanly interpretable features of the input. For example, in an “ideal” ImageNet classifier, each neuron would fire only in the presence of a specific visual feature, such as the color red, a left-facing curve, or a dog snout. Empirically, in models we have studied, some of the neurons do cleanly map to features. But it isn't always the case that features correspond so cleanly to neurons, especially in large language models where it actually seems rare for neurons to correspond to clean features. This brings up many questions. Why is it that neurons sometimes align with features and sometimes don't? Why do some models and tasks have many of these clean neurons, while they're vanishingly rare in others? In this paper, we use toy models — small ReLU networks trained on synthetic data with sparse input features — to investigate how and when models represent more features than they have dimensions. We call this phenomenon superposition. When features are sparse, superposition allows compression beyond what a linear model would do, at the cost of "interference" that requires nonlinear filtering. submitted by /u/shitboots [link] [comments]  ( 104 min )

The model can output multiple images with different viewpoints? How can we combine them into a 3D mesh model file??? many thanks :) submitted by /u/JC1DA [link] [comments]  ( 88 min )

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Hi guys, I developed a prototype virtual AI assistant called Luna to assist visually impaired people. In the current implementation, Luna is successfully able to have conversations and respond to enquiries about the following topics: a) things it can see b) if there is food to eat c) whether there is anything to drink d) threats in this scene e) the location of the user. Below link is to my LinkedIn post where a 40 second demo. https://www.linkedin.com/posts/rishil-darne-78326658_artificialintelligence-computervision-ai-activity-6976184548300623872-XU92?utm_source=share&utm_medium=member_android submitted by /u/Avatar_d2 [link] [comments]  ( 100 min )

submitted by /u/CardboardDreams [link] [comments]  ( 90 min )

Is it worth the monthly subscription? I was not impressed with the demo at all and currently looking at writing AI options to help with my novel writing. More of a creative thought process for me. Let me know thanks guys submitted by /u/leg18 [link] [comments]  ( 87 min )

​ https://preview.redd.it/upfqiyhjd2o91.png?width=512&format=png&auto=webp&s=7acc95da5cf8144752c55c41cf55122b43b0685f submitted by /u/account_name4 [link] [comments]  ( 87 min )

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I have a project in mind that involves AI, mostly computer vision. I still don't know much about AI, only the basics like the different types of machine learning. Any advice on what to learn and any ressources that could be useful? submitted by /u/Moemen02 [link] [comments]  ( 88 min )

We all know and love/hate Moore's law, but has anyone attempted to put together a similar metric for AI? Maybe it would need to be domain specific like performance in NLP, or CV tasks. Perhaps an aggregate of multiple benchmarks across multiple fields to test generality? It could even be a simple as the number of nodes in a production NN, or something. It would be interesting to follow a metric like this over the next decade as I'm sure it would double faster than 18 months. submitted by /u/TrainquilOasis1423 [link] [comments]  ( 93 min )

I just had an idea I thought would be really useful and was wondering if anyone was working on it. I was wondering if an AI could scan a legal document (such as a EULA), and cut out all the unnecessary stuff and provide a plain explanation for what it says. I doubt this would ever replace a real lawyer, but it could be super helpful for certain stuff. Some other documents like instruction manuals are also over-explained and it could be extremely useful to have it trimmed down to something more manageable/reasonable. submitted by /u/SniperFiction [link] [comments]  ( 87 min )

My understanding is an artificial intelligence is an algorithm with more than one action which is chosen based on state. However this would make any algorithm with an if statement an AI, which sounds off… Can somebody clarify? submitted by /u/shsuGknGe5Bvd685hH [link] [comments]  ( 99 min )

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Hi everyone, Our team has built an automated Speech Recognition service that generates subtitle files for any video or audio file and can translate into 45+ languages. It's powered fully by Deep Learning and beats other implementations like YouTube captions. If you'd like to try it with your own content, it's free to create an account and use. Learn more about it here: https://www.smartmine.net/video-services/subtitling-description Try it free here: https://ai.smartmine.net/service/speech-recognition/captioning It has some great features like: Accurate subtitles powered by DL Speech recognition in 11 languages DL-powered translation into 45+ languages Multiple speaker recognition Subtitle editor to fine-tune results The ASR methodology is best described by this paper: https://arxiv.org/pdf/2111.09296.pdf We re-trained the models using the Mozilla Common Voice data set (a lot of other implementations use the LibriSpeech data set, but it's much more limited and renders worse results). Training was performed on a cluster of 8 RTX 3090 GPUs (the 24GB of memory is really helpful for using larger sequence lengths). We're a small company, so we would really appreciate any feedback you have! submitted by /u/aL_eX49 [link] [comments]  ( 88 min )

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Hello! In my AI Subject we have to research and implement a working AI starting by writing the state of art,then doing the prototype and which tools are going to be used and then developing the AI. We are totally free to do whatever you want, provided that we can implement the AI. I don't have a good imagination/creativity so i came here asking for ideias. It's my first subject going deep into AI so my knowledge in developing and all the learning types is pretty superficial so it has to be something that a beginner like me can "easilly" develop or learn to do it. We can use whatever tools we want be it Unity, OpenAI,etc and create whatever we want. I have some insights in ML(Deep Learning and Reinformecent Learning) since in my last subject we learned it in the theory but never implemented something like it. So i appreciate all ideas,where to start,what to use! The due date is in december but i have to write the state of art until mid October. submitted by /u/alfaces12 [link] [comments]  ( 93 min )

I know Real-ESRGAN any others? submitted by /u/typcalthowawayacount [link] [comments]  ( 87 min )

Help us!! We are a team of academic researchers interested in psychology and natural language use. We are currently interested in gathering some data from people with no psychological disorders. More information: https://erisk.irlab.org/ We would greatly appreciate if you could fill the questionnaire attached. It takes 2 minutes :) It is a standard inventory of questions used by psychologists. Note that the questionnaire contains a field in which the respondent has to provide his/her Reddit username. This would help us to link word use (as extracted from your Reddit's public submissions) with your responses to the questionnaire. Of course, we will treat the information you provide with the utmost confidentiality and privacy. All information we will extract from Reddit will be anonymised. Link to the questionnaire: https://forms.gle/PkWyB64aAu6BQTqi6 Best regards David E. Losada, Univ. Santiago de Compostela, Spain ([david.losada@usc.es](mailto:david.losada@usc.es)) Fabio Crestani, Univ. della Svizzera Italiana, Switzerland ([fabio.crestani@usi.ch](mailto:fabio.crestani@usi.ch)) Javier Parapar, Univ. A Coruña, Spain ([javierparapar@udc.es](mailto:javierparapar@udc.es)) Patricia Martin-Rodilla, Univ. A Coruña, Spain ([patricia.martin.rodilla@udc.es](mailto:patricia.martin.rodilla@udc.es) ) submitted by /u/pamroda [link] [comments]  ( 87 min )

submitted by /u/Greatgg [link] [comments]  ( 90 min )

Hello colleagues, We are organizing the 12th International Conference on Artificial Intelligence in Music, Sound, Art and Design (EvoMUSART) and we think it may be of interest to many of you. The conference will take place in Brno, Czech Republic, between 12 and 14 April 2023. If you work with Artificial Intelligence techniques applied to visual art, music, sound synthesis, architecture, video, poetry, design or other creative tasks, you can present your work at this conference. If not, it is also a great opportunity to know all the news of research in these fields. For more information, visit the event's webpage: https://www.evostar.org/2023/evomusart/ ​ https://preview.redd.it/w1v10wr0gzn91.png?width=4167&format=png&auto=webp&s=d5f0e9e008f631ea8aec12cfe2e2d0639b336d76 submitted by /u/evomusart_conference [link] [comments]  ( 88 min )

submitted by /u/Zirius_Sadfaces [link] [comments]  ( 87 min )

How much actual coding is required? I guess how much time should I spend on learning Java, if I understand the basics? submitted by /u/Lucky_Plastic_3113 [link] [comments]  ( 87 min )

Growing up in a military family, Christopher Scott moved more than 30 times, which instilled in him “the ability to be comfortable with, and even motivated by, new environments,” he said. The post Meet the Omnivore: Christopher Scott Constructs Architectural Designs, Virtual Environments With NVIDIA Omniverse appeared first on NVIDIA Blog.  ( 6 min )

TGIGFNT: thank goodness it’s GFN Thursday. Start your weekend early with seven new games joining the GeForce NOW library of over 1,400 titles. Whether it’s streaming on an older-than-the-dinosaurs PC, a Mac that normally couldn’t dream of playing PC titles, or mobile devices – it’s all possible to play your way thanks to GeForce NOW. Read article > The post GFN Thursday Delivers Seven New Games This Week appeared first on NVIDIA Blog.  ( 4 min )

Posted by Xi Chen and Xiao Wang, Software Engineers, Google Research Advanced language models (e.g., GPT, GLaM, PaLM and T5) have demonstrated diverse capabilities and achieved impressive results across tasks and languages by scaling up their number of parameters. Vision-language (VL) models can benefit from similar scaling to address many tasks, such as image captioning, visual question answering (VQA), object recognition, and in-context optical-character-recognition (OCR). Increasing the success rates for these practical tasks is important for everyday interactions and applications. Furthermore, for a truly universal system, vision-language models should be able to operate in many languages, not just one. In “PaLI: A Jointly-Scaled Multilingual Language-Image Model”, we introduce a uni…  ( 27 min )

As the population ages, there is an increasing need for healthcare services. More people live longer than ever before, so they are likely…  ( 10 min )

Amazon SageMaker Studio Lab is a free machine learning (ML) development environment based on open-source JupyterLab for anyone to learn and experiment with ML using AWS ML compute resources. It’s based on the same architecture and user interface as Amazon SageMaker Studio, but with a subset of Studio capabilities. When you begin working on ML […]  ( 8 min )

Hello, I try to create DQN agent that has to learn to detect attacks/intrusions, however the agent achieves a very low accuracy (20%) so it didn't learn anything. I will be very grateful if anyone helps to find where is the problem exactly and how to improve the accuracy . This is the code: import gym import numpy as np import pandas as pd import numpy as np import pandas as pd import matplotlib.pyplot as plt from sklearn.preprocessing import LabelEncoder,OneHotEncoder from sklearn import preprocessing from sklearn.feature_selection import RFE from sklearn.tree import DecisionTreeClassifier from sklearn.model_selection import train_test_split from sklearn.metrics import confusion_matrix import json import random from collections import deque import time from tqdm.notebook import tqdm fr…  ( 92 min )

Hi, I am an independent researcher on deep reinforcement learning, with passion to achieve ultimate goal of general AI. However, recently I heard some point of view from another professor, which is that doing DRL is boring, just about ranking, better scores on simulations etc. Besides, it is also pointed out that it can not generalize well on other tasks though perform well on MuJoCo or Atari games. It is actually vague in my opinion. When I sit down and review this comment, I think though there are many things in DRL really tedious such as sweeping hyperparameters, or improving performance, it is still the most promising way to achieve that goal, at which I feel excited and motivated. That is why I go along such a long way and may continue. What are your thoughts on DRL, and this point of view? Any shares are appreciated! submitted by /u/OutOfCharm [link] [comments]  ( 96 min )

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We consider the problem of estimating an upper bound on the capacity of a memoryless channel with unknown channel law and continuous output alphabet. A novel data-driven algorithm is proposed that exploits the dual representation of capacity where the maximization over the input distribution is replaced with a minimization over a reference distribution on the channel output. To efficiently compute the required divergence maximization between the conditional channel and the reference distribution, we use a modified mutual information neural estimator that takes the channel input as an additional parameter. We numerically evaluate our approach on different memoryless channels and show empirically that the estimated upper bounds closely converge either to the channel capacity or to best-known lower bounds.  ( 2 min )

Pretrained language models have been shown to be effective in many software-related generation tasks; however, they are not well-suited for editing tasks as they are not designed to reason about edits. To address this, we propose a novel pretraining objective which explicitly models edits and use it to build CoditT5, a large language model for software-related editing tasks that is pretrained on large amounts of source code and natural language comments. We fine-tune it on various downstream editing tasks, including comment updating, bug fixing, and automated code review. By outperforming standard generation-based models, we demonstrate the generalizability of our approach and its suitability for editing tasks. We also show how a standard generation model and our edit-based model can complement one another through simple reranking strategies, with which we achieve state-of-the-art performance for the three downstream editing tasks.  ( 2 min )

Beamforming-capable antenna arrays overcome the high free-space path loss at higher carrier frequencies. However, the beams must be properly aligned to ensure that the highest power is radiated towards (and received by) the user equipment (UE). While there are methods that improve upon an exhaustive search for optimal beams by some form of hierarchical search, they can be prone to return only locally optimal solutions with small beam gains. Other approaches address this problem by exploiting contextual information, e.g., the position of the UE or information from neighboring base stations (BS), but the burden of computing and communicating this additional information can be high. Methods based on machine learning so far suffer from the accompanying training, performance monitoring and deployment complexity that hinders their application at scale. This paper proposes a novel method for solving the initial beam-discovery problem. It is scalable, and easy to tune and to implement. Our algorithm is based on a recommender system that associates groups (i.e., UEs) and preferences (i.e., beams from a codebook) based on a training data set. Whenever a new UE needs to be served our algorithm returns the best beams in this user cluster. Our simulation results demonstrate the efficiency and robustness of our approach, not only in single BS setups but also in setups that require a coordination among several BSs. Our method consistently outperforms standard baseline algorithms in the given task.  ( 3 min )

The increasing size of input graphs for graph neural networks (GNNs) highlights the demand for using multi-GPU platforms. However, existing multi-GPU GNN solutions suffer from inferior performance due to imbalanced computation and inefficient communication. To this end, we propose MGG, a novel system design to accelerate GNNs on multi-GPU platforms via a GPU-centric software pipeline. MGG explores the potential of hiding remote memory access latency in GNN workloads through fine-grained computation-communication pipelining. Specifically, MGG introduces a pipeline-aware workload management strategy and a hybrid data layout design to facilitate communication-computation overlapping. MGG implements an optimized pipeline-centric kernel. It includes workload interleaving and warp-based mapping for efficient GPU kernel operation pipelining and specialized memory designs and optimizations for better data access performance. Besides, MGG incorporates lightweight analytical modeling and optimization heuristics to dynamically improve the GNN execution performance for different settings at runtime. Comprehensive experiments demonstrate that MGG outperforms state-of-the-art multi-GPU systems across various GNN settings: on average 3.65X faster than multi-GPU systems with a unified virtual memory design and on average 7.38X faster than the DGCL framework.  ( 2 min )

We revisit the method of mixture technique, also known as the Laplace method, to study the concentration phenomenon in generic exponential families. Combining the properties of Bregman divergence associated with log-partition function of the family with the method of mixtures for super-martingales, we establish a generic bound controlling the Bregman divergence between the parameter of the family and a finite sample estimate of the parameter. Our bound is time-uniform and makes appear a quantity extending the classical information gain to exponential families, which we call the Bregman information gain. For the practitioner, we instantiate this novel bound to several classical families, e.g., Gaussian, Bernoulli, Exponential, Weibull, Pareto, Poisson and Chi-square yielding explicit forms of the confidence sets and the Bregman information gain. We further numerically compare the resulting confidence bounds to state-of-the-art alternatives for time-uniform concentration and show that this novel method yields competitive results. Finally, we highlight the benefit of our concentration bounds on some illustrative applications.  ( 2 min )

Supervised classification techniques use training samples to learn a classification rule with small expected 0-1 loss (error probability). Conventional methods enable tractable learning and provide out-of-sample generalization by using surrogate losses instead of the 0-1 loss and considering specific families of rules (hypothesis classes). This paper presents minimax risk classifiers (MRCs) that minimize the worst-case 0-1 loss over general classification rules and provide tight performance guarantees at learning. We show that MRCs are strongly universally consistent using feature mappings given by characteristic kernels. The paper also proposes efficient optimization techniques for MRC learning and shows that the methods presented can provide accurate classification together with tight performance guarantees in practice.  ( 2 min )

This paper investigates a new online learning problem with doubly-streaming data, where the data streams are described by feature spaces that constantly evolve, with new features emerging and old features fading away. The challenges of this problem are two folds: 1) Data samples ceaselessly flowing in may carry shifted patterns over time, requiring learners to update hence adapt on-the-fly. 2) Newly emerging features are described by very few samples, resulting in weak learners that tend to make error predictions. A plausible idea to overcome the challenges is to establish relationship between the pre-and-post evolving feature spaces, so that an online learner can leverage the knowledge learned from the old features to better the learning performance on the new features. Unfortunately, this idea does not scale up to high-dimensional media streams with complex feature interplay, which suffers an tradeoff between onlineness (biasing shallow learners) and expressiveness(requiring deep learners). Motivated by this, we propose a novel OLD^3S paradigm, where a shared latent subspace is discovered to summarize information from the old and new feature spaces, building intermediate feature mapping relationship. A key trait of OLD^3S is to treat the model capacity as a learnable semantics, yields optimal model depth and parameters jointly, in accordance with the complexity and non-linearity of the input data streams in an online fashion. Both theoretical analyses and empirical studies substantiate the viability and effectiveness of our proposal.  ( 3 min )

In recent years, deep learning has achieved remarkable empirical success for image reconstruction. This has catalyzed an ongoing quest for precise characterization of correctness and reliability of data-driven methods in critical use-cases, for instance in medical imaging. Notwithstanding the excellent performance and efficacy of deep learning-based methods, concerns have been raised regarding their stability, or lack thereof, with serious practical implications. Significant advances have been made in recent years to unravel the inner workings of data-driven image recovery methods, challenging their widely perceived black-box nature. In this article, we will specify relevant notions of convergence for data-driven image reconstruction, which will form the basis of a survey of learned methods with mathematically rigorous reconstruction guarantees. An example that is highlighted is the role of ICNN, offering the possibility to combine the power of deep learning with classical convex regularization theory for devising methods that are provably convergent. This survey article is aimed at both methodological researchers seeking to advance the frontiers of our understanding of data-driven image reconstruction methods as well as practitioners, by providing an accessible description of useful convergence concepts and by placing some of the existing empirical practices on a solid mathematical foundation.  ( 3 min )

The mechanisms by which certain training interventions, such as increasing learning rates and applying batch normalization, improve the generalization of deep networks remains a mystery. Prior works have speculated that "flatter" solutions generalize better than "sharper" solutions to unseen data, motivating several metrics for measuring flatness (particularly $\lambda_{max}$, the largest eigenvalue of the Hessian of the loss); and algorithms, such as Sharpness-Aware Minimization (SAM) [1], that directly optimize for flatness. Other works question the link between $\lambda_{max}$ and generalization. In this paper, we present findings that call $\lambda_{max}$'s influence on generalization further into question. We show that: (1) while larger learning rates reduce $\lambda_{max}$ for all batch sizes, generalization benefits sometimes vanish at larger batch sizes; (2) by scaling batch size and learning rate simultaneously, we can change $\lambda_{max}$ without affecting generalization; (3) while SAM produces smaller $\lambda_{max}$ for all batch sizes, generalization benefits (also) vanish with larger batch sizes; (4) for dropout, excessively high dropout probabilities can degrade generalization, even as they promote smaller $\lambda_{max}$; and (5) while batch-normalization does not consistently produce smaller $\lambda_{max}$, it nevertheless confers generalization benefits. While our experiments affirm the generalization benefits of large learning rates and SAM for minibatch SGD, the GD-SGD discrepancy demonstrates limits to $\lambda_{max}$'s ability to explain generalization in neural networks.  ( 3 min )

Recent breakthroughs based on big/foundation models reveal a vague avenue for AI, that is, \emph{bid data, big/foundation models, big learning, $\cdots$}. Following that avenue, here we elaborate on our newly introduced big learning. Specifically, big learning exhaustively exploits the information/tasks inherent in its large-scale \emph{complete/incomplete} training data, by learning to simultaneously model many-to-all joint/conditional/marginal data distributions (thus named big learning) with one universal foundation model. We reveal that big learning is what existing foundation models are implicitly doing; accordingly, our big learning provides high-level guidance for flexible design and improvements of foundation models. Besides, big learning ($i$) is equipped with great flexibilities for complete/incomplete training data and for customizing trustworthy data tasks; ($ii$) potentially delivers all joint/conditional/marginal data capabilities after training; ($iii$) significantly reduces the training-test gap with improved model generalization; and ($iv$) potentially unifies conventional machine learning paradigms and enables their flexible cooperations, manifesting a universal learning paradigm. Preliminary experiments verified the effectiveness of the presented big learning.  ( 2 min )

Foodborne illness is a serious but preventable public health problem -- with delays in detecting the associated outbreaks resulting in productivity loss, expensive recalls, public safety hazards, and even loss of life. While social media is a promising source for identifying unreported foodborne illnesses, there is a dearth of labeled datasets for developing effective outbreak detection models. To accelerate the development of machine learning-based models for foodborne outbreak detection, we thus present TWEET-FID (TWEET-Foodborne Illness Detection), the first publicly available annotated dataset for multiple foodborne illness incident detection tasks. TWEET-FID collected from Twitter is annotated with three facets: tweet class, entity type, and slot type, with labels produced by experts as well as by crowdsource workers. We introduce several domain tasks leveraging these three facets: text relevance classification (TRC), entity mention detection (EMD), and slot filling (SF). We describe the end-to-end methodology for dataset design, creation, and labeling for supporting model development for these tasks. A comprehensive set of results for these tasks leveraging state-of-the-art single- and multi-task deep learning methods on the TWEET-FID dataset are provided. This dataset opens opportunities for future research in foodborne outbreak detection.  ( 3 min )

We study representations of data from an arbitrary metric space $\mathcal{X}$ in the space of univariate Gaussian mixtures with a transport metric (Delon and Desolneux 2020). We derive embedding guarantees for feature maps implemented by small neural networks called \emph{probabilistic transformers}. Our guarantees are of memorization type: we prove that a probabilistic transformer of depth about $n\log(n)$ and width about $n^2$ can bi-H\"{o}lder embed any $n$-point dataset from $\mathcal{X}$ with low metric distortion, thus avoiding the curse of dimensionality. We further derive probabilistic bi-Lipschitz guarantees which trade off the amount of distortion and the probability that a randomly chosen pair of points embeds with that distortion. If $\mathcal{X}$'s geometry is sufficiently regular, we obtain stronger, bi-Lipschitz guarantees for all points in the dataset. As applications we derive neural embedding guarantees for datasets from Riemannian manifolds, metric trees, and certain types of combinatorial graphs.  ( 2 min )

Standard federated optimization methods successfully apply to stochastic problems with single-level structure. However, many contemporary ML problems -- including adversarial robustness, hyperparameter tuning, and actor-critic -- fall under nested bilevel programming that subsumes minimax and compositional optimization. In this work, we propose \fedblo: A federated alternating stochastic gradient method to address general nested problems. We establish provable convergence rates for \fedblo in the presence of heterogeneous data and introduce variations for bilevel, minimax, and compositional optimization. \fedblo introduces multiple innovations including federated hypergradient computation and variance reduction to address inner-level heterogeneity. We complement our theory with experiments on hyperparameter \& hyper-representation learning and minimax optimization that demonstrate the benefits of our method in practice. Code is available at https://github.com/ucr-optml/FedNest.  ( 2 min )

Cyber-physical systems (CPSs) are usually complex and safety-critical; hence, it is difficult and important to guarantee that the system's requirements, i.e., specifications, are fulfilled. Simulation-based falsification of CPSs is a practical testing method that can be used to raise confidence in the correctness of the system by only requiring that the system under test can be simulated. As each simulation is typically computationally intensive, an important step is to reduce the number of simulations needed to falsify a specification. We study Bayesian optimization (BO), a sample-efficient method that learns a surrogate model that describes the relationship between the parametrization of possible input signals and the evaluation of the specification. In this paper, we improve the falsification using BO by; first adopting two prominent BO methods, one fits local surrogate models, and the other exploits the user's prior knowledge. Secondly, the formulation of acquisition functions for falsification is addressed in this paper. Benchmark evaluation shows significant improvements in using local surrogate models of BO for falsifying benchmark examples that were previously hard to falsify. Using prior knowledge in the falsification process is shown to be particularly important when the simulation budget is limited. For some of the benchmark problems, the choice of acquisition function clearly affects the number of simulations needed for successful falsification.  ( 3 min )

Voice trigger detection is an important task, which enables activating a voice assistant when a target user speaks a keyword phrase. A detector is typically trained on speech data independent of speaker information and used for the voice trigger detection task. However, such a speaker independent voice trigger detector typically suffers from performance degradation on speech from underrepresented groups, such as accented speakers. In this work, we propose a novel voice trigger detector that can use a small number of utterances from a target speaker to improve detection accuracy. Our proposed model employs an encoder-decoder architecture. While the encoder performs speaker independent voice trigger detection, similar to the conventional detector, the decoder predicts a personalized embedding for each utterance. A personalized voice trigger score is then obtained as a similarity score between the embeddings of enrollment utterances and a test utterance. The personalized embedding allows adapting to target speaker's speech when computing the voice trigger score, hence improving voice trigger detection accuracy. Experimental results show that the proposed approach achieves a 38% relative reduction in a false rejection rate (FRR) compared to a baseline speaker independent voice trigger model.  ( 3 min )

Single-cell RNA-seq datasets are growing in size and complexity, enabling the study of cellular composition changes in various biological/clinical contexts. Scalable dimensionality reduction techniques are in need to disentangle biological variation in them, while accounting for technical and biological confounders. In this work, we extend a popular approach for probabilistic non-linear dimensionality reduction, the Gaussian process latent variable model, to scale to massive single-cell datasets while explicitly accounting for technical and biological confounders. The key idea is to use an augmented kernel which preserves the factorisability of the lower bound allowing for fast stochastic variational inference. We demonstrate its ability to reconstruct latent signatures of innate immunity recovered in Kumasaka et al. (2021) with 9x lower training time. We further analyze a COVID dataset and demonstrate across a cohort of 130 individuals, that this framework enables data integration while capturing interpretable signatures of infection. Specifically, we explore COVID severity as a latent dimension to refine patient stratification and capture disease-specific gene expression.  ( 2 min )

Bayesian workflows often require the introduction of nuisance parameters, yet for core science modelling one needs access to a marginal posterior density. In this work we use masked autoregressive flows and kernel density estimators to encapsulate the marginal posterior, allowing us to compute marginal Kullback-Leibler divergences and marginal Bayesian model dimensionalities in addition to generating samples and computing marginal log probabilities. We demonstrate this in application to topical cosmological examples of the Dark Energy Survey, and global 21cm signal experiments. In addition to the computation of marginal Bayesian statistics, this work is important for further applications in Bayesian experimental design, complex prior modelling and likelihood emulation. This technique is made publicly available in the pip-installable code margarine.  ( 2 min )

We propose a Langevin diffusion-based algorithm for non-convex optimization and sampling on a product manifold of spheres. Under a logarithmic Sobolev inequality, we establish a guarantee for finite iteration convergence to the Gibbs distribution in terms of Kullback--Leibler divergence. We show that with an appropriate temperature choice, the suboptimality gap to the global minimum is guaranteed to be arbitrarily small with high probability. As an application, we consider the Burer--Monteiro approach for solving a semidefinite program (SDP) with diagonal constraints, and analyze the proposed Langevin algorithm for optimizing the non-convex objective. In particular, we establish a logarithmic Sobolev inequality for the Burer--Monteiro problem when there are no spurious local minima, but under the presence saddle points. Combining the results, we then provide a global optimality guarantee for the SDP and the Max-Cut problem. More precisely, we show that the Langevin algorithm achieves $\epsilon$ accuracy with high probability in $\widetilde{\Omega}( \epsilon^{-5} )$ iterations.

Sequential manipulation tasks require a robot to perceive the state of an environment and plan a sequence of actions leading to a desired goal state. In such tasks, the ability to reason about spatial relations among object entities from raw sensor inputs is crucial in order to determine when a task has been completed and which actions can be executed. In this work, we propose SORNet (Spatial Object-Centric Representation Network), a framework for learning object-centric representations from RGB images conditioned on a set of object queries, represented as image patches called canonical object views. With only a single canonical view per object and no annotation, SORNet generalizes zero-shot to object entities whose shape and texture are both unseen during training. We evaluate SORNet on various spatial reasoning tasks such as spatial relation classification and relative direction regression in complex tabletop manipulation scenarios and show that SORNet significantly outperforms baselines including state-of-the-art representation learning techniques. We also demonstrate the application of the representation learned by SORNet on visual-servoing and task planning for sequential manipulation on a real robot.

Helmholtz Machines (HMs) are a class of generative models composed of two Sigmoid Belief Networks (SBNs), acting respectively as an encoder and a decoder. These models are commonly trained using a two-step optimization algorithm called Wake-Sleep (WS) and more recently by improved versions, such as Reweighted Wake-Sleep (RWS) and Bidirectional Helmholtz Machines (BiHM). The locality of the connections in an SBN induces sparsity in the Fisher Information Matrices associated to the probabilistic models, in the form of a finely-grained block-diagonal structure. In this paper we exploit this property to efficiently train SBNs and HMs using the natural gradient. We present a novel algorithm, called Natural Reweighted Wake-Sleep (NRWS), that corresponds to the geometric adaptation of its standard version. In a similar manner, we also introduce Natural Bidirectional Helmholtz Machine (NBiHM). Differently from previous work, we will show how for HMs the natural gradient can be efficiently computed without the need of introducing any approximation in the structure of the Fisher information matrix. The experiments performed on standard datasets from the literature show a consistent improvement of NRWS and NBiHM not only with respect to their non-geometric baselines but also with respect to state-of-the-art training algorithms for HMs. The improvement is quantified both in terms of speed of convergence as well as value of the log-likelihood reached after training.

The goal of the paper is to design active learning strategies which lead to domain adaptation under an assumption of Lipschitz functions. Building on previous work by Mansour et al. (2009) we adapt the concept of discrepancy distance between source and target distributions to restrict the maximization over the hypothesis class to a localized class of functions which are performing accurate labeling on the source domain. We derive generalization error bounds for such active learning strategies in terms of Rademacher average and localized discrepancy for general loss functions which satisfy a regularity condition. A practical K-medoids algorithm that can address the case of large data set is inferred from the theoretical bounds. Our numerical experiments show that the proposed algorithm is competitive against other state-of-the-art active learning techniques in the context of domain adaptation, in particular on large data sets of around one hundred thousand images.

This paper considers parameter estimation for nonlinear state-space models, which is an important but challenging problem. We address this challenge by employing a variational inference (VI) approach, which is a principled method that has deep connections to maximum likelihood estimation. This VI approach ultimately provides estimates of the model as solutions to an optimisation problem, which is deterministic, tractable and can be solved using standard optimisation tools. A specialisation of this approach for systems with additive Gaussian noise is also detailed. The proposed method is examined numerically on a range of simulated and real examples focusing on the robustness to parameter initialisation; additionally, favourable comparisons are performed against state-of-the-art alternatives.

Audio-visual automatic speech recognition (AV-ASR) extends speech recognition by introducing the video modality as an additional source of information. In this work, the information contained in the motion of the speaker's mouth is used to augment the audio features. The video modality is traditionally processed with a 3D convolutional neural network (e.g. 3D version of VGG). Recently, image transformer networks arXiv:2010.11929 demonstrated the ability to extract rich visual features for image classification tasks. Here, we propose to replace the 3D convolution with a video transformer to extract visual features. We train our baselines and the proposed model on a large scale corpus of YouTube videos. The performance of our approach is evaluated on a labeled subset of YouTube videos as well as on the LRS3-TED public corpus. Our best video-only model obtains 34.9% WER on YTDEV18 and 19.3% on LRS3-TED, a 10% and 9% relative improvements over our convolutional baseline. We achieve the state of the art performance of the audio-visual recognition on the LRS3-TED after fine-tuning our model (1.6% WER). In addition, in a series of experiments on multi-person AV-ASR, we obtained an average relative reduction of 2% WER over our convolutional video frontend.

We investigate models that can generate arbitrary natural language text (e.g. all English sentences) from a bounded, convex and well-behaved control space. We call them universal vec2text models. Such models would allow making semantic decisions in the vector space (e.g. via reinforcement learning) while the natural language generation is handled by the vec2text model. We propose four desired properties: universality, diversity, fluency, and semantic structure, that such vec2text models should possess and we provide quantitative and qualitative methods to assess them. We implement a vec2text model by adding a bottleneck to a 250M parameters Transformer model and training it with an auto-encoding objective on 400M sentences (10B tokens) extracted from a massive web corpus. We propose a simple data augmentation technique based on round-trip translations and show in extensive experiments that the resulting vec2text model surprisingly leads to vector spaces that fulfill our four desired properties and that this model strongly outperforms both standard and denoising auto-encoders.

The problem of decentralized multi-robot target tracking asks for jointly selecting actions, e.g., motion primitives, for the robots to maximize target tracking performance with local communications. One major challenge for practical implementations is to make target tracking approaches scalable for large-scale problem instances. In this work, we propose a general-purpose learning architecture toward collaborative target tracking at scale, with decentralized communications. Particularly, our learning architecture leverages a graph neural network (GNN) to capture local interactions of the robots and learns decentralized decision-making for the robots. We train the learning model by imitating an expert solution and implement the resulting model for decentralized action selection involving local observations and communications only. We demonstrate the performance of our GNN-based learning approach in a scenario of active target tracking with large networks of robots. The simulation results show our approach nearly matches the tracking performance of the expert algorithm, and yet runs several orders faster with up to 100 robots. Moreover, it slightly outperforms a decentralized greedy algorithm but runs faster (especially with more than 20 robots). The results also exhibit our approach's generalization capability in previously unseen scenarios, e.g., larger environments and larger networks of robots.

Scientific machine learning (SciML) is a field of increasing interest in several different application fields. In an optimization context, SciML-based tools have enabled the development of more efficient optimization methods. However, implementing SciML tools for optimization must be rigorously evaluated and performed with caution. This work proposes the deductions of a robustness test that guarantees the robustness of multiobjective SciML-based optimization by showing that its results respect the universal approximator theorem. The test is applied in the framework of a novel methodology which is evaluated in a series of benchmarks illustrating its consistency. Moreover, the proposed methodology results are compared with feasible regions of rigorous optimization, which requires a significantly higher computational effort. Hence, this work provides a robustness test for guaranteed robustness in applying SciML tools in multiobjective optimization with lower computational effort than the existent alternative.

Bayesian learning via Stochastic Gradient Langevin Dynamics (SGLD) has been suggested for differentially private learning. While previous research provides differential privacy bounds for SGLD at the initial steps of the algorithm or when close to convergence, the question of what differential privacy guarantees can be made in between remains unanswered. This interim region is of great importance, especially for Bayesian neural networks, as it is hard to guarantee convergence to the posterior. This paper shows that using SGLD might result in unbounded privacy loss for this interim region, even when sampling from the posterior is as differentially private as desired.

We study linear filters for processing signals supported on abstract topological spaces modeled as simplicial complexes, which may be interpreted as generalizations of graphs that account for nodes, edges, triangular faces etc. To process such signals, we develop simplicial convolutional filters defined as matrix polynomials of the lower and upper Hodge Laplacians. First, we study the properties of these filters and show that they are linear and shift-invariant, as well as permutation and orientation equivariant. These filters can also be implemented in a distributed fashion with a low computational complexity, as they involve only (multiple rounds of) simplicial shifting between upper and lower adjacent simplices. Second, focusing on edge-flows, we study the frequency responses of these filters and examine how we can use the Hodge-decomposition to delineate gradient, curl and harmonic frequencies. We discuss how these frequencies correspond to the lower- and the upper-adjacent couplings and the kernel of the Hodge Laplacian, respectively, and can be tuned independently by our filter designs. Third, we study different procedures for designing simplicial convolutional filters and discuss their relative advantages. Finally, we corroborate our simplicial filters in several applications: to extract different frequency components of a simplicial signal, to denoise edge flows, and to analyze financial markets and traffic networks.

Animals are able to rapidly infer from limited experience when sets of state action pairs have equivalent reward and transition dynamics. On the other hand, modern reinforcement learning systems must painstakingly learn through trial and error that sets of state action pairs are value equivalent -- requiring an often prohibitively large amount of samples from their environment. MDP homomorphisms have been proposed that reduce the observed MDP of an environment to an abstract MDP, which can enable more sample efficient policy learning. Consequently, impressive improvements in sample efficiency have been achieved when a suitable MDP homomorphism can be constructed a priori -- usually by exploiting a practioner's knowledge of environment symmetries. We propose a novel approach to constructing a homomorphism in discrete action spaces, which uses a partial model of environment dynamics to infer which state action pairs lead to the same state -- reducing the size of the state-action space by a factor equal to the cardinality of the action space. We call this method equivalent effect abstraction. In a gridworld setting, we demonstrate empirically that equivalent effect abstraction can improve sample efficiency in a model-free setting and planning efficiency for modelbased approaches. Furthermore, we show on cartpole that our approach outperforms an existing method for learning homomorphisms, while using 33x less training data.

Road construction projects maintain transportation infrastructures. These projects range from the short-term (e.g., resurfacing or fixing potholes) to the long-term (e.g., adding a shoulder or building a bridge). Deciding what the next construction project is and when it is to be scheduled is traditionally done through inspection by humans using special equipment. This approach is costly and difficult to scale. An alternative is the use of computational approaches that integrate and analyze multiple types of past and present spatiotemporal data to predict location and time of future road constructions. This paper reports on such an approach, one that uses a deep-neural-network-based model to predict future constructions. Our model applies both convolutional and recurrent components on a heterogeneous dataset consisting of construction, weather, map and road-network data. We also report on how we addressed the lack of adequate publicly available data - by building a large scale dataset named "US-Constructions", that includes 6.2 million cases of road constructions augmented by a variety of spatiotemporal attributes and road-network features, collected in the contiguous United States (US) between 2016 and 2021. Using extensive experiments on several major cities in the US, we show the applicability of our work in accurately predicting future constructions - an average f1-score of 0.85 and accuracy 82.2% - that outperform baselines. Additionally, we show how our training pipeline addresses spatial sparsity of data.

Fluorescence microscopy is a key driver to promote discoveries of biomedical research. However, with the limitation of microscope hardware and characteristics of the observed samples, the fluorescence microscopy images are susceptible to noise. Recently, a few self-supervised deep learning (DL) denoising methods have been proposed. However, the training efficiency and denoising performance of existing methods are relatively low in real scene noise removal. To address this issue, this paper proposed self-supervised image denoising method Noise2SR (N2SR) to train a simple and effective image denoising model based on single noisy observation. Our Noise2SR denoising model is designed for training with paired noisy images of different dimensions. Benefiting from this training strategy, Noise2SR is more efficiently self-supervised and able to restore more image details from a single noisy observation. Experimental results of simulated noise and real microscopy noise removal show that Noise2SR outperforms two blind-spot based self-supervised deep learning image denoising methods. We envision that Noise2SR has the potential to improve more other kind of scientific imaging quality.

Sequential recommender systems have shown effective suggestions by capturing users' interest drift. There have been two groups of existing sequential models: user- and item-centric models. The user-centric models capture personalized interest drift based on each user's sequential consumption history, but do not explicitly consider whether users' interest in items sustains beyond the training time, i.e., interest sustainability. On the other hand, the item-centric models consider whether users' general interest sustains after the training time, but it is not personalized. In this work, we propose a recommender system taking advantages of the models in both categories. Our proposed model captures personalized interest sustainability, indicating whether each user's interest in items will sustain beyond the training time or not. We first formulate a task that requires to predict which items each user will consume in the recent period of the training time based on users' consumption history. We then propose simple yet effective schemes to augment users' sparse consumption history. Extensive experiments show that the proposed model outperforms 10 baseline models on 11 real-world datasets. The codes are available at https://github.com/dmhyun/PERIS.

AI-generated synthetic data allows to distill the general patterns of existing data, that can then be shared safely as granular-level representative, yet novel data samples within the original semantics. In this work we explore approaches of incorporating domain expertise into the data synthesis, to have the statistical properties as well as pre-existing domain knowledge of rules be represented. The resulting synthetic data generator, that can be probed for any number of new samples, can then serve as a common source of intelligence, as a lingua franca of learning, consumable by humans and machines alike. We demonstrate the concept for a publicly available data set, and evaluate its benefits via descriptive analysis as well as a downstream ML model.

Federated Learning (FL) has opened the opportunity for collaboratively training machine learning models on heterogeneous mobile or Edge devices while keeping local data private.With an increase in its adoption, a growing concern is related to its economic and environmental cost (as is also the case for other machine learning techniques).Unfortunately, little work has been done to optimize its energy consumption or emissions of carbon dioxide or equivalents, as energy minimization is usually left as a secondary objective.In this paper, we investigate the problem of minimizing the energy consumption of FL training on heterogeneous devices by controlling the workload distribution.We model this as the Minimal Cost FL Schedule problem, a total cost minimization problem with identical, independent, and atomic tasks that have to be assigned to heterogeneous resources with arbitrary cost functions.We propose a pseudo-polynomial optimal solution to the problem based on the previously unexplored Multiple-Choice Minimum-Cost Maximal Knapsack Packing Problem.We also provide four algorithms for scenarios where cost functions are monotonically increasing and follow the same behavior.These solutions are likewise applicable on the minimization of other kinds of costs, and in other one-dimensional data partition problems.

Forward gradients have been recently introduced to bypass backpropagation in autodifferentiation, while retaining unbiased estimators of true gradients. We derive an optimality condition to obtain best approximating forward gradients, which leads us to mathematical insights that suggest optimization in high dimension is challenging with forward gradients. Our extensive experiments on test functions support this claim.

Graph neural networks (GNNs) have become compelling models designed to perform learning and inference on graph-structured data, but little work has been done on understanding the fundamental limitations of GNNs to be scalable to larger graphs and generalized to out-of-distribution inputs. In this paper, we use a random graph generator that allows us to systematically investigate how the graph size and structural properties affect the predictive performance of GNNs. We present specific evidence that, among the many graph properties, the mean and modality of the node degree distribution are the key features that determine whether GNNs can generalize to unseen graphs. Accordingly, we propose flexible GNNs (Flex-GNNs), using multiple node update functions and the inner loop optimization as a generalization to the single type of canonical nonlinear transformation over aggregated inputs, allowing the network to adapt flexibly to new graphs. The Flex-GNN framework improves the generalization out of the training set on several inference tasks.

Monitoring plankton populations in situ is fundamental to preserve the aquatic ecosystem. Plankton microorganisms are in fact susceptible of minor environmental perturbations, that can reflect into consequent morphological and dynamical modifications. Nowadays, the availability of advanced automatic or semi-automatic acquisition systems has been allowing the production of an increasingly large amount of plankton image data. The adoption of machine learning algorithms to classify such data may be affected by the significant cost of manual annotation, due to both the huge quantity of acquired data and the numerosity of plankton species. To address these challenges, we propose an efficient unsupervised learning pipeline to provide accurate classification of plankton microorganisms. We build a set of image descriptors exploiting a two-step procedure. First, a Variational Autoencoder (VAE) is trained on features extracted by a pre-trained neural network. We then use the learnt latent space as image descriptor for clustering. We compare our method with state-of-the-art unsupervised approaches, where a set of pre-defined hand-crafted features is used for clustering of plankton images. The proposed pipeline outperforms the benchmark algorithms for all the plankton datasets included in our analysis, providing better image embedding properties.

Large variability between cell lines brings a difficult optimization problem of drug selection for cancer therapy. Standard approaches use prediction of value for this purpose, corresponding e.g. to expected value of their distribution. This article shows superiority of working on, predicting the entire probability distributions - proposing basic tools for this purpose. We are mostly interested in the best drug in their batch to be tested - proper optimization of their selection for extreme statistics requires knowledge of the entire probability distributions, which for distributions of drug properties among cell lines often turn out binomial, e.g. depending on corresponding gene. Hence for basic prediction mechanism there is proposed mixture of two Gaussians, trying to predict its weight based on additional information.

We consider the multi-user detection (MUD) problem in uplink grant-free non-orthogonal multiple access (NOMA), where the access point has to identify the total number and correct identity of the active Internet of Things (IoT) devices and decode their transmitted data. We assume that IoT devices use complex spreading sequences and transmit information in a random-access manner following the burst-sparsity model, where some IoT devices transmit their data in multiple adjacent time slots with a high probability, while others transmit only once during a frame. Exploiting the temporal correlation, we propose an attention-based bidirectional long short-term memory (BiLSTM) network to solve the MUD problem. The BiLSTM network creates a pattern of the device activation history using forward and reverse pass LSTMs, whereas the attention mechanism provides essential context to the device activation points. By doing so, a hierarchical pathway is followed for detecting active devices in a grant-free scenario. Then, by utilising the complex spreading sequences, blind data detection for the estimated active devices is performed. The proposed framework does not require prior knowledge of device sparsity levels and channels for performing MUD. The results show that the proposed network achieves better performance compared to existing benchmark schemes.

Neural forecasting of spatiotemporal time series drives both research and industrial innovation in several relevant application domains. Graph neural networks (GNNs) are often the core component of the forecasting architecture. However, in most spatiotemporal GNNs, the computational complexity scales up to a quadratic factor with the length of the sequence times the number of links in the graph, hence hindering the application of these models to large graphs and long temporal sequences. While methods to improve scalability have been proposed in the context of static graphs, few research efforts have been devoted to the spatiotemporal case. To fill this gap, we propose a scalable architecture that exploits an efficient encoding of both temporal and spatial dynamics. In particular, we use a randomized recurrent neural network to embed the history of the input time series into high-dimensional state representations encompassing multi-scale temporal dynamics. Such representations are then propagated along the spatial dimension using different powers of the graph adjacency matrix to generate node embeddings characterized by a rich pool of spatiotemporal features. The resulting node embeddings can be efficiently pre-computed in an unsupervised manner, before being fed to a feed-forward decoder that learns to map the multi-scale spatiotemporal representations to predictions. The training procedure can then be parallelized node-wise by sampling the node embeddings without breaking any dependency, thus enabling scalability to large networks. Empirical results on relevant datasets show that our approach achieves results competitive with the state of the art, while dramatically reducing the computational burden.

Tensegrity robots, composed of rigid rods and flexible cables, exhibit high strength-to-weight ratios and extreme deformations, enabling them to navigate unstructured terrain and even survive harsh impacts. However, they are hard to control due to their high dimensionality, complex dynamics, and coupled architecture. Physics-based simulation is one avenue for developing locomotion policies that can then be transferred to real robots, but modeling tensegrity robots is a complex task, so simulations experience a substantial sim2real gap. To address this issue, this paper describes a Real2Sim2Real strategy for tensegrity robots. This strategy is based on a differential physics engine that can be trained given limited data from a real robot (i.e. offline measurements and one random trajectory) and achieve a high enough accuracy to discover transferable locomotion policies. Beyond the overall pipeline, key contributions of this work include computing non-zero gradients at contact points, a loss function, and a trajectory segmentation technique that avoid conflicts in gradient evaluation during training. The proposed pipeline is demonstrated and evaluated on a real 3-bar tensegrity robot.  ( 2 min )

When processing a batch of graphs in machine learning models such as Graph Neural Networks (GNN), it is common to combine several small graphs into one overall graph to accelerate processing and reduce the overhead of padding. This is for example supported in the PyG library. However, the sizes of small graphs can vary substantially with respect to the number of nodes and edges, and hence the size of the combined graph can still vary considerably, especially for small batch sizes. So the costs of excessive padding and wasted compute are still incurred. This paper proposes a new approach -- tuple packing -- for generating batches that cause minimal overhead. The algorithm extends recently introduced sequence packing approaches to work on the 2D tuples of (|nodes|, |edges|). A monotone heuristic is applied to the 2D histogram of tuple values to define a priority for packing histogram bins together with the objective to reach a limit on the number of nodes as well as the number of edges. Experiments verify the effectiveness of the algorithm on multiple datasets.  ( 2 min )

Flapping-fin unmanned underwater vehicle (UUV) propulsion systems provide high maneuverability for naval tasks such as surveillance and terrain exploration. Recent work has explored the use of time-series neural network surrogate models to predict thrust from vehicle design and fin kinematics. We develop a search-based inverse model that leverages a kinematics-to-thrust neural network model for control system design. Our inverse model finds a set of fin kinematics with the multi-objective goal of reaching a target thrust and creating a smooth kinematic transition between flapping cycles. We demonstrate how a control system integrating this inverse model can make online, cycle-to-cycle adjustments to prioritize different system objectives.  ( 2 min )

Stochastic processes provide a mathematically elegant way model complex data. In theory, they provide flexible priors over function classes that can encode a wide range of interesting assumptions. In practice, however, efficient inference by optimisation or marginalisation is difficult, a problem further exacerbated with big data and high dimensional input spaces. We propose a novel variational autoencoder (VAE) called the prior encoding variational autoencoder ($\pi$VAE). The $\pi$VAE is finitely exchangeable and Kolmogorov consistent, and thus is a continuous stochastic process. We use $\pi$VAE to learn low dimensional embeddings of function classes. We show that our framework can accurately learn expressive function classes such as Gaussian processes, but also properties of functions to enable statistical inference (such as the integral of a log Gaussian process). For popular tasks, such as spatial interpolation, $\pi$VAE achieves state-of-the-art performance both in terms of accuracy and computational efficiency. Perhaps most usefully, we demonstrate that the low dimensional independently distributed latent space representation learnt provides an elegant and scalable means of performing Bayesian inference for stochastic processes within probabilistic programming languages such as Stan.  ( 3 min )

Symbolic regression is a nonlinear regression method which is commonly performed by an evolutionary computation method such as genetic programming. Quantification of uncertainty of regression models is important for the interpretation of models and for decision making. The linear approximation and so-called likelihood profiles are well-known possibilities for the calculation of confidence and prediction intervals for nonlinear regression models. These simple and effective techniques have been completely ignored so far in the genetic programming literature. In this work we describe the calculation of likelihood profiles in details and also provide some illustrative examples with models created with three different symbolic regression algorithms on two different datasets. The examples highlight the importance of the likelihood profiles to understand the limitations of symbolic regression models and to help the user taking an informed post-prediction decision.  ( 2 min )

Tongue twisters are meaningful sentences that are difficult to pronounce. The process of automatically generating tongue twisters is challenging since the generated utterance must satisfy two conditions at once: phonetic difficulty and semantic meaning. Furthermore, phonetic difficulty is itself hard to characterize and is expressed in natural tongue twisters through a heterogeneous mix of phenomena such as alliteration and homophony. In this paper, we propose PANCETTA: Phoneme Aware Neural Completion to Elicit Tongue Twisters Automatically. We leverage phoneme representations to capture the notion of phonetic difficulty, and we train language models to generate original tongue twisters on two proposed task settings. To do this, we curate a dataset called PANCETTA, consisting of existing English tongue twisters. Through automatic and human evaluation, as well as qualitative analysis, we show that PANCETTA generates novel, phonetically difficult, fluent, and semantically meaningful tongue twisters.  ( 2 min )

Existing clustering algorithms such as K-means often need to preset parameters such as the number of categories K, and such parameters may lead to the failure to output objective and consistent clustering results. This paper introduces a clustering method based on the information theory, by which clusters in the clustering result have maximum average information entropy (called entropy payload in this paper). This method can bring the following benefits: firstly, this method does not need to preset any super parameter such as category number or other similar thresholds, secondly, the clustering results have the maximum information expression efficiency. it can be used in image segmentation, object classification, etc., and could be the basis of unsupervised learning.  ( 2 min )

The ability to accelerate the design of biological sequences can have a substantial impact on the progress of the medical field. The problem can be framed as a global optimization problem where the objective is an expensive black-box function such that we can query large batches restricted with a limitation of a low number of rounds. Bayesian Optimization is a principled method for tackling this problem. However, the astronomically large state space of biological sequences renders brute-force iterating over all possible sequences infeasible. In this paper, we propose MetaRLBO where we train an autoregressive generative model via Meta-Reinforcement Learning to propose promising sequences for selection via Bayesian Optimization. We pose this problem as that of finding an optimal policy over a distribution of MDPs induced by sampling subsets of the data acquired in the previous rounds. Our in-silico experiments show that meta-learning over such ensembles provides robustness against reward misspecification and achieves competitive results compared to existing strong baselines.

Nowadays, transformer-based models gradually become the default choice for artificial intelligence pioneers. The models also show superiority even in the few-shot scenarios. In this paper, we revisit the classical methods and propose a new few-shot alternative. Specifically, we investigate the few-shot one-class problem, which actually takes a known sample as a reference to detect whether an unknown instance belongs to the same class. This problem can be studied from the perspective of sequence match. It is shown that with meta-learning, the classical sequence match method, i.e. Compare-Aggregate, significantly outperforms transformer ones. The classical approach requires much less training cost. Furthermore, we perform an empirical comparison between two kinds of sequence match approaches under simple fine-tuning and meta-learning. Meta-learning causes the transformer models' features to have high-correlation dimensions. The reason is closely related to the number of layers and heads of transformer models. Experimental codes and data are available at https://github.com/hmt2014/FewOne

Deep learning-based techniques have been introduced into the field of trajectory optimization in recent years. Deep Neural Networks (DNNs) are trained and used as the surrogates of conventional optimization process. They can provide low thrust (LT) transfer cost estimation and enable more complex preliminary mission designs. However, it is a challenge to efficiently obtain the required amount of trajectory data for training. A Generative Adversarial Network (GAN) is adapted to generate the feasible LT trajectory data efficiently. The GAN consists of a generator and a discriminator, both of which are deep networks. The generator generates fake LT transfer features using random noise as input, while the discriminator distinguishes the generator's fake LT transfer features from real LT transfer features. The GAN is trained until the generator generates fake LT transfers that the discriminator cannot identify. This indicates the generator generates low thrust transfer features that have the same distribution as the real transfer features. The generated low thrust transfer data have a high convergence rate, and they can be used to efficiently produce training data for deep learning models. The proposed approach is validated by generating feasible LT transfers in a Near-Earth Asteroid (NEA) mission scenario. The convergence rate of GAN-generated samples is 84.3%.

For a long time, different recommendation tasks typically require designing task-specific architectures and training objectives. As a result, it is hard to transfer the learned knowledge and representations from one task to another, thus restricting the generalization ability of existing recommendation approaches, e.g., a sequential recommendation model can hardly be applied or transferred to a review generation method. To deal with such issues, considering that language can describe almost anything and language grounding is a powerful medium to represent various problems or tasks, we present a flexible and unified text-to-text paradigm called "Pretrain, Personalized Prompt, and Predict Paradigm" (P5) for recommendation, which unifies various recommendation tasks in a shared framework. In P5, all data such as user-item interactions, user descriptions, item metadata, and user reviews are converted to a common format -- natural language sequences. The rich information from natural language assists P5 to capture deeper semantics for personalization and recommendation. Specifically, P5 learns different tasks with the same language modeling objective during pretraining. Thus, it serves as the foundation model for various downstream recommendation tasks, allows easy integration with other modalities, and enables instruction-based recommendation based on prompts. P5 advances recommender systems from shallow model to deep model to big model, and will revolutionize the technical form of recommender systems towards universal recommendation engine. With adaptive personalized prompt for different users, P5 is able to make predictions in a zero-shot or few-shot manner and largely reduces the necessity for extensive fine-tuning. On several recommendation benchmarks, we conduct experiments to show the effectiveness of P5. We release the source code at https://github.com/jeykigung/P5.

Network architecture search (NAS) has become a common approach to developing and discovering new neural architectures for different target platforms and purposes. However, scanning the search space is comprised of long training processes of many candidate architectures, which is costly in terms of computational resources and time. Regression algorithms are a common tool to predicting a candidate architecture's accuracy, which can dramatically accelerate the search procedure. We aim at proposing a new baseline that will support the development of regression algorithms that can predict an architecture's accuracy just from its scheme, or by only training it for a minimal number of epochs. Therefore, we introduce the NAAP-440 dataset of 440 neural architectures, which were trained on CIFAR10 using a fixed recipe. Our experiments indicate that by using off-the-shelf regression algorithms and running up to 10% of the training process, not only is it possible to predict an architecture's accuracy rather precisely, but that the values predicted for the architectures also maintain their accuracy order with a minimal number of monotonicity violations. This approach may serve as a powerful tool for accelerating NAS-based studies and thus dramatically increase their efficiency. The dataset and code used in the study have been made public.  ( 2 min )

The remarkable progress in deep learning in recent years is largely driven by improvements in scale, where bigger models are trained on larger datasets for longer schedules. To predict the benefit of scale empirically, we argue for a more rigorous methodology based on the extrapolation loss, instead of reporting the best-fitting (interpolating) parameters. We then present a recipe for estimating scaling law parameters reliably from learning curves. We demonstrate that it extrapolates more accurately than previous methods in a wide range of architecture families across several domains, including image classification, neural machine translation (NMT) and language modeling, in addition to tasks from the BIG-Bench evaluation benchmark. Finally, we release a benchmark dataset comprising of 90 evaluation tasks to facilitate research in this domain.  ( 2 min )

Multimodal machine learning has been widely studied for the development of general intelligence. Recently, the remarkable multimodal algorithms, the Perceiver and Perceiver IO, show competitive results for diverse dataset domains and tasks. However, recent works, Perceiver and Perceiver IO, have focused on heterogeneous modalities, including image, text, and speech, and there are few research works for graph structured datasets. A graph is one of the most generalized dataset structures, and we can represent the other dataset, including images, text, and speech, as graph structured data. A graph has an adjacency matrix different from other dataset domains such as text and image, and it is not trivial to handle the topological information, relational information, and canonical positional information. In this study, we provide a Graph Perceiver IO, the Perceiver IO for the graph structured dataset. We keep the main structure of the Graph Perceiver IO as the Perceiver IO because the Perceiver IO already handles the diverse dataset well, except for the graph structured dataset. The Graph Perceiver IO is a general method, and it can handle diverse datasets such as graph structured data as well as text and images. Comparing the graph neural networks, the Graph Perceiver IO requires a lower complexity, and it can incorporate the local and global information efficiently. We show that Graph Perceiver IO shows competitive results for diverse graph-related tasks, including node classification, graph classification, and link prediction.  ( 3 min )

The privacy risks of machine learning models is a major concern when training them on sensitive and personal data. We discuss the tradeoffs between data privacy and the remaining goals of trustworthy machine learning (notably, fairness, robustness, and explainability).  ( 2 min )

Assessing drug-target affinity is a critical step in the drug discovery and development process, but to obtain such data experimentally is both time consuming and expensive. For this reason, computational methods for predicting binding strength are being widely developed. However, these methods typically use a single-task approach for prediction, thus ignoring the additional information that can be extracted from the data and used to drive the learning process. Thereafter in this work, we present a multi-task approach for binding strength prediction. Our results suggest that these prediction can indeed benefit from a multi-task learning approach, by utilizing added information from related tasks and multi-task induced regularization.  ( 2 min )

Deep reinforcement learning has shown an ability to achieve super-human performance in solving complex reinforcement learning (RL) tasks only from raw-pixels. However, it fails to reuse knowledge from previously learnt tasks to solve new, unseen ones. Generalizing and reusing knowledge are the fundamental requirements for creating a truly intelligent agent. This work proposes a general method for one-to-one transfer learning based on generative adversarial network model tailored to RL task.  ( 2 min )

Among the reasons that hinder the application of reinforcement learning (RL) to real-world problems, two factors are critical: limited data and the mismatch of the testing environment compared to training one. In this paper, we attempt to address these issues simultaneously with the problem setup of distributionally robust offline RL. Particularly, we learn an RL agent with the historical data obtained from the source environment and optimize it to perform well in the perturbed one. Moreover, we consider the linear function approximation to apply the algorithm to large-scale problems. We prove our algorithm can achieve the suboptimality of $O(1/\sqrt{K})$ depending on the linear function dimension $d$, which seems to be the first result with sample complexity guarantee in this setting. Diverse experiments are conducted to demonstrate our theoretical findings, showing the superiority of our algorithm against the non-robust one.  ( 2 min )

The Medical Internet of Things, a recent technological advancement in medicine, is incredibly helpful in providing real-time monitoring of health metrics. This paper presents a non-invasive IoT system that tracks patients' emotions, especially those with autism spectrum disorder. With a few affordable sensors and cloud computing services, the individual's heart rates are monitored and analyzed to study the effects of changes in sweat and heartbeats per minute for different emotions. Under normal resting conditions of the individual, the proposed system could detect the right emotion using machine learning algorithms with a performance of up to 92% accuracy. The result of the proposed approach is comparable with the state-of-the-art solutions in medical IoT.  ( 2 min )

In this paper, federated learning (FL) over wireless networks is investigated. In each communication round, a subset of devices is selected to participate in the aggregation with limited time and energy. In order to minimize the convergence time, global loss and latency are jointly considered in a Stackelberg game based framework. Specifically, age of information (AoI) based device selection is considered at leader-level as a global loss minimization problem, while sub-channel assignment, computational resource allocation, and power allocation are considered at follower-level as a latency minimization problem. By dividing the follower-level problem into two sub-problems, the best response of the follower is obtained by a monotonic optimization based resource allocation algorithm and a matching based sub-channel assignment algorithm. By deriving the upper bound of convergence rate, the leader-level problem is reformulated, and then a list based device selection algorithm is proposed to achieve Stackelberg equilibrium. Simulation results indicate that the proposed device selection scheme outperforms other schemes in terms of the global loss, and the developed algorithms can significantly decrease the time consumption of computation and communication.  ( 2 min )

Road network and trajectory representation learning are essential for traffic systems since the learned representation can be directly used in various downstream tasks (e.g., traffic speed inference, and travel time estimation). However, most existing methods only contrast within the same scale, i.e., treating road network and trajectory separately, which ignores valuable inter-relations. In this paper, we aim to propose a unified framework that jointly learns the road network and trajectory representations end-to-end. We design domain-specific augmentations for road-road contrast and trajectory-trajectory contrast separately, i.e., road segment with its contextual neighbors and trajectory with its detour replaced and dropped alternatives, respectively. On top of that, we further introduce the road-trajectory cross-scale contrast to bridge the two scales by maximizing the total mutual information. Unlike the existing cross-scale contrastive learning methods on graphs that only contrast a graph and its belonging nodes, the contrast between road segment and trajectory is elaborately tailored via novel positive sampling and adaptive weighting strategies. We conduct prudent experiments based on two real-world datasets with four downstream tasks, demonstrating improved performance and effectiveness. The code is available at https://github.com/mzy94/JCLRNT.  ( 2 min )

Plasticity and stability are needed in class-incremental learning in order to learn from new data while preserving past knowledge. Due to catastrophic forgetting, finding a compromise between these two properties is particularly challenging when no memory buffer is available. Mainstream methods need to store two deep models since they integrate new classes using fine tuning with knowledge distillation from the previous incremental state. We propose a method which has similar number of parameters but distributes them differently in order to find a better balance between plasticity and stability. Following an approach already deployed by transfer-based incremental methods, we freeze the feature extractor after the initial state. Classes in the oldest incremental states are trained with this frozen extractor to ensure stability. Recent classes are predicted using partially fine-tuned models in order to introduce plasticity. Our proposed plasticity layer can be incorporated to any transfer-based method designed for memory-free incremental learning, and we apply it to two such methods. Evaluation is done with three large-scale datasets. Results show that performance gains are obtained in all tested configurations compared to existing methods.  ( 2 min )

Classifiers have been widely implemented in practice, while how to evaluate them properly remains a problem. Commonly used two types of metrics respectively based on confusion matrix and loss function have different advantages in flexibility and mathematical completeness, while they struggle in different dilemmas like the insensitivity to slight improvements or the lack of customizability in different tasks. In this paper, we propose a novel metric named Meta Pattern Concern Score based on the abstract representation of the probabilistic prediction, as well as the targeted design for processing negative classes in multi-classification and reducing the discreteness of metric value, to achieve advantages of both the two kinds of metrics and avoid their weaknesses. Our metric provides customizability to pick out the model for specific requirements in different practices, and make sure it is also fine under traditional metrics at the same time. Evaluation in four kinds of models and six datasets demonstrates the effectiveness and efficiency of our metric, and a case study shows it can select a model to reduce 0.53% of dangerous misclassifications by sacrificing only 0.04% of training accuracy.

We study the problem of estimating an unknown parameter in a distributed and online manner. Existing work on distributed online learning typically either focuses on asymptotic analysis, or provides bounds on regret. However, these results may not directly translate into bounds on the error of the learned model after a finite number of time-steps. In this paper, we propose a distributed online estimation algorithm which enables each agent in a network to improve its estimation accuracy by communicating with neighbors. We provide non-asymptotic bounds on the estimation error, leveraging the statistical properties of the underlying model. Our analysis demonstrates a trade-off between estimation error and communication costs. Further, our analysis allows us to determine a time at which the communication can be stopped (due to the costs associated with communications), while meeting a desired estimation accuracy. We also provide a numerical example to validate our results.

Multi-relational networks play an important role in today's world and are utilized to capture complex relationships between the data. Their applications span many domains such as biomedical, financial, social, etc., and because of their increasing usability, it becomes crucial to find efficient ways to deal with the added complexity of multiple layers. In this work, we propose a novel approach to represent these complex networks using a single aggregated adjacency matrix, by utilizing primes as surrogates for the relations. Due to the fundamental theorem of arithmetic, this allows for a lossless, compact representation of the whole multi-relational graph, using a single adjacency matrix. Moreover, this representation enables the fast computation of multi-hop adjacency matrices, that can be useful for a variety of downstream tasks. We present simple and complex tasks in which this representation can be useful and showcase its efficiency and performance. Finally, we also provide insights on the advantages and the open challenges that still need to be addressed and motivate future work.  ( 2 min )

Despite the empirical successes of self-supervised learning (SSL) methods, it is unclear what characteristics of their representations lead to high downstream accuracies. In this work, we characterize properties that SSL representations should ideally satisfy. Specifically, we prove necessary and sufficient conditions such that for any task invariant to given data augmentations, desired probes (e.g., linear or MLP) trained on that representation attain perfect accuracy. These requirements lead to a unifying conceptual framework for improving existing SSL methods and deriving new ones. For contrastive learning, our framework prescribes simple but significant improvements to previous methods such as using asymmetric projection heads. For non-contrastive learning, we use our framework to derive a simple and novel objective. Our resulting SSL algorithms outperform baselines on standard benchmarks, including SwAV+multicrops on linear probing of ImageNet.  ( 2 min )

Computer vision (CV) is a big and important field in artificial intelligence covering a wide range of applications. Image analysis is a major task in CV aiming to extract, analyse and understand the visual content of images. However, image-related tasks are very challenging due to many factors, e.g., high variations across images, high dimensionality, domain expertise requirement, and image distortions. Evolutionary computation (EC) approaches have been widely used for image analysis with significant achievement. However, there is no comprehensive survey of existing EC approaches to image analysis. To fill this gap, this paper provides a comprehensive survey covering all essential EC approaches to important image analysis tasks including edge detection, image segmentation, image feature analysis, image classification, object detection, and others. This survey aims to provide a better understanding of evolutionary computer vision (ECV) by discussing the contributions of different approaches and exploring how and why EC is used for CV and image analysis. The applications, challenges, issues, and trends associated to this research field are also discussed and summarised to provide further guidelines and opportunities for future research.

Discovering a meaningful, dimensionally homogeneous, symbolic expression that explains experimental data is a fundamental challenge in many scientific fields. We present a novel, open-source computational framework called Scientist-Machine Equation Detector (SciMED), which integrates scientific discipline wisdom in a scientist-in-the-loop approach with state-of-the-art symbolic regression (SR) methods. SciMED combines a genetic algorithm-based wrapper selection method with automatic machine learning and two levels of SR methods. We test SciMED on four configurations of the settling of a sphere with and without a non-linear aerodynamic drag force. We show that SciMED is sufficiently robust to discover the correct physically meaningful symbolic expressions from noisy data. Our results indicate better performance on these tasks than the state-of-the-art SR software package.  ( 2 min )

In operating Rooms (ORs), activities are usually different from other typical working environments. In particular, surgeons are frequently exposed to multiple psycho-organizational constraints that may cause negative repercussions on their health and performance. This is commonly attributed to an increase in the associated Cognitive Workload (CWL) that results from dealing with unexpected and repetitive tasks, as well as large amounts of information and potentially risky cognitive overload. In this paper, a cascade of two machine learning approaches is suggested for the multimodal recognition of CWL in a number of four different surgical tasks. First, a model based on the concept of transfer learning is used to identify if a surgeon is experiencing any CWL. Secondly, a Convolutional Neural Network (CNN) uses this information to identify different types of CWL associated to each surgical task. The suggested multimodal approach consider adjacent signals from electroencephalogram (EEG), functional near-infrared spectroscopy (fNIRS) and pupil eye diameter. The concatenation of signals allows complex correlations in terms of time (temporal) and channel location (spatial). Data collection is performed by a Multi-sensing AI Environment for Surgical Task $\&$ Role Optimisation platform (MAESTRO) developed at HARMS Lab. To compare the performance of the proposed methodology, a number of state-of-art machine learning techniques have been implemented. The tests show that the proposed model has a precision of 93%.  ( 3 min )

Nowadays Artificial Intelligence (AI) has become a fundamental component of healthcare applications, both clinical and remote, but the best performing AI systems are often too complex to be self-explaining. Explainable AI (XAI) techniques are defined to unveil the reasoning behind the system's predictions and decisions, and they become even more critical when dealing with sensitive and personal health data. It is worth noting that XAI has not gathered the same attention across different research areas and data types, especially in healthcare. In particular, many clinical and remote health applications are based on tabular and time series data, respectively, and XAI is not commonly analysed on these data types, while computer vision and Natural Language Processing (NLP) are the reference applications. To provide an overview of XAI methods that are most suitable for tabular and time series data in the healthcare domain, this paper provides a review of the literature in the last 5 years, illustrating the type of generated explanations and the efforts provided to evaluate their relevance and quality. Specifically, we identify clinical validation, consistency assessment, objective and standardised quality evaluation, and human-centered quality assessment as key features to ensure effective explanations for the end users. Finally, we highlight the main research challenges in the field as well as the limitations of existing XAI methods.  ( 3 min )

Person Re-Identification (Re-ID) aims to search for a person of interest (query) in a network of cameras. In the classic Re-ID setting the query is sought in a gallery containing properly cropped images of entire bodies. Recently, the live Re-ID setting was introduced to represent the practical application context of Re-ID better. It consists in searching for the query in short videos, containing whole scene frames. The initial live Re-ID baseline used a pedestrian detector to build a large search gallery and a classic Re-ID model to find the query in the gallery. However, the galleries generated were too large and contained low-quality images, which decreased the live Re-ID performance. Here, we present a new live Re-ID approach called TrADe, to generate lower high-quality galleries. TrADe first uses a Tracking algorithm to identify sequences of images of the same individual in the gallery. Following, an Anomaly Detection model is used to select a single good representative of each tracklet. TrADe is validated on the live Re-ID version of the PRID-2011 dataset and shows significant improvements over the baseline.  ( 2 min )

Speech is inherently continuous, where discrete words, phonemes and other units are not clearly segmented, and so speech recognition has been an active research problem for decades. In this work we have fine-tuned wav2vec 2.0 to recognize and transcribe Bengali speech -- training it on the Bengali Common Voice Speech Dataset. After training for 71 epochs, on a training set consisting of 36919 mp3 files, we achieved a training loss of 0.3172 and WER of 0.2524 on a validation set of size 7,747. Using a 5-gram language model, the Levenshtein Distance was 2.6446 on a test set of size 7,747. Then the training set and validation set were combined, shuffled and split into 85-15 ratio. Training for 7 more epochs on this combined dataset yielded an improved Levenshtein Distance of 2.60753 on the test set. Our model was the best performing one, achieving a Levenshtein Distance of 6.234 on a hidden dataset, which was 1.1049 units lower than other competing submissions.  ( 2 min )

Security concerns about a machine learning model used in a prediction-as-a-service include the privacy of the model, the query and the result. Secure inference solutions based on homomorphic encryption (HE) and/or multiparty computation (MPC) have been developed to protect all the sensitive information. One of the most efficient type of solution utilizes HE for linear layers, and MPC for non-linear layers. However, for such hybrid protocols with semi-honest security, an adversary can malleate the intermediate features in the inference process, and extract model information more effectively than methods against inference service in plaintext. In this paper, we propose SEEK, a general extraction method for hybrid secure inference services outputing only class labels. This method can extract each layer of the target model independently, and is not affected by the depth of the model. For ResNet-18, SEEK can extract a parameter with less than 50 queries on average, with average error less than $0.03\%$.  ( 2 min )

Automatic Speech Recognition models require large amount of speech data for training, and the collection of such data often leads to privacy concerns. Federated learning has been widely used and is considered to be an effective decentralized technique by collaboratively learning a shared prediction model while keeping the data local on different clients devices. However, the limited computation and communication resources on clients devices present practical difficulties for large models. To overcome such challenges, we propose Federated Pruning to train a reduced model under the federated setting, while maintaining similar performance compared to the full model. Moreover, the vast amount of clients data can also be leveraged to improve the pruning results compared to centralized training. We explore different pruning schemes and provide empirical evidence of the effectiveness of our methods.  ( 2 min )

Understanding causality helps to structure interventions to achieve specific goals and enables predictions under interventions. With the growing importance of learning causal relationships, causal discovery tasks have transitioned from using traditional methods to infer potential causal structures from observational data to the field of pattern recognition involved in deep learning. The rapid accumulation of massive data promotes the emergence of causal search methods with brilliant scalability. Existing summaries of causal discovery methods mainly focus on traditional methods based on constraints, scores and FCMs, there is a lack of perfect sorting and elaboration for deep learning-based methods, also lacking some considers and exploration of causal discovery methods from the perspective of variable paradigms. Therefore, we divide the possible causal discovery tasks into three types according to the variable paradigm and give the definitions of the three tasks respectively, define and instantiate the relevant datasets for each task and the final causal model constructed at the same time, then reviews the main existing causal discovery methods for different tasks. Finally, we propose some roadmaps from different perspectives for the current research gaps in the field of causal discovery and point out future research directions.  ( 3 min )

Research articles are being shared in increasing numbers on multiple online platforms. Although the scholarly impact of these articles has been widely studied, the online interest determined by how long the research articles are shared online remains unclear. Being cognizant of how long a research article is mentioned online could be valuable information to the researchers. In this paper, we analyzed multiple social media platforms on which users share and/or discuss scholarly articles. We built three clusters for papers, based on the number of yearly online mentions having publication dates ranging from the year 1920 to 2016. Using the online social media metrics for each of these three clusters, we built machine learning models to predict the long-term online interest in research articles. We addressed the prediction task with two different approaches: regression and classification. For the regression approach, the Multi-Layer Perceptron model performed best, and for the classification approach, the tree-based models performed better than other models. We found that old articles are most evident in the contexts of economics and industry (i.e., patents). In contrast, recently published articles are most evident in research platforms (i.e., Mendeley) followed by social media platforms (i.e., Twitter).  ( 3 min )

Deep Learning (DL) models increasingly power a diversity of applications. Unfortunately, this pervasiveness also makes them attractive targets for extraction attacks which can steal the architecture, parameters, and hyper-parameters of a targeted DL model. Existing extraction attack studies have observed varying levels of attack success for different DL models and datasets, yet the underlying cause(s) behind their susceptibility often remain unclear. Ascertaining such root-cause weaknesses would help facilitate secure DL systems, though this requires studying extraction attacks in a wide variety of scenarios to identify commonalities across attack success and DL characteristics. The overwhelmingly high technical effort and time required to understand, implement, and evaluate even a single attack makes it infeasible to explore the large number of unique extraction attack scenarios in existence, with current frameworks typically designed to only operate for specific attack types, datasets and hardware platforms. In this paper we present PINCH: an efficient and automated extraction attack framework capable of deploying and evaluating multiple DL models and attacks across heterogeneous hardware platforms. We demonstrate the effectiveness of PINCH by empirically evaluating a large number of previously unexplored extraction attack scenarios, as well as secondary attack staging. Our key findings show that 1) multiple characteristics affect extraction attack success spanning DL model architecture, dataset complexity, hardware, attack type, and 2) partially successful extraction attacks significantly enhance the success of further adversarial attack staging.  ( 3 min )

Graph contrastive learning (GCL) has emerged as an effective tool for learning unsupervised representations of graphs. The key idea is to maximize the agreement between two augmented views of each graph via data augmentation. Existing GCL models mainly focus on applying \textit{identical augmentation strategies} for all graphs within a given scenario. However, real-world graphs are often not monomorphic but abstractions of diverse natures. Even within the same scenario (e.g., macromolecules and online communities), different graphs might need diverse augmentations to perform effective GCL. Thus, blindly augmenting all graphs without considering their individual characteristics may undermine the performance of GCL arts.To deal with this, we propose the first principled framework, termed as \textit{G}raph contrastive learning with \textit{P}ersonalized \textit{A}ugmentation (GPA), to advance conventional GCL by allowing each graph to choose its own suitable augmentation operations.In essence, GPA infers tailored augmentation strategies for each graph based on its topology and node attributes via a learnable augmentation selector, which is a plug-and-play module and can be effectively trained with downstream GCL models end-to-end. Extensive experiments across 11 benchmark graphs from different types and domains demonstrate the superiority of GPA against state-of-the-art competitors.Moreover, by visualizing the learned augmentation distributions across different types of datasets, we show that GPA can effectively identify the most suitable augmentations for each graph based on its characteristics.  ( 2 min )

Deep learning has become one of remote sensing scientists' most efficient computer vision tools in recent years. However, the lack of training labels for the remote sensing datasets means that scientists need to solve the domain adaptation problem to narrow the discrepancy between satellite image datasets. As a result, image segmentation models that are then trained, could better generalize and use an existing set of labels instead of requiring new ones. This work proposes an unsupervised domain adaptation model that preserves semantic consistency and per-pixel quality for the images during the style-transferring phase. This paper's major contribution is proposing the improved architecture of the SemI2I model, which significantly boosts the proposed model's performance and makes it competitive with the state-of-the-art CyCADA model. A second contribution is testing the CyCADA model on the remote sensing multi-band datasets such as WorldView-2 and SPOT-6. The proposed model preserves semantic consistency and per-pixel quality for the images during the style-transferring phase. Thus, the semantic segmentation model, trained on the adapted images, shows substantial performance gain compared to the SemI2I model and reaches similar results as the state-of-the-art CyCADA model. The future development of the proposed method could include ecological domain transfer, {\em a priori} evaluation of dataset quality in terms of data distribution, or exploration of the inner architecture of the domain adaptation model.  ( 3 min )

Reed relay serves as the fundamental component of functional testing, which closely relates to the successful quality inspection of electronics. To provide accurate remaining useful life (RUL) estimation for reed relay, a hybrid deep learning network with degradation pattern clustering is proposed based on the following three considerations. First, multiple degradation behaviors are observed for reed relay, and hence a dynamic time wrapping-based $K$-means clustering is offered to distinguish degradation patterns from each other. Second, although proper selections of features are of great significance, few studies are available to guide the selection. The proposed method recommends operational rules for easy implementation purposes. Third, a neural network for remaining useful life estimation (RULNet) is proposed to address the weakness of the convolutional neural network (CNN) in capturing temporal information of sequential data, which incorporates temporal correlation ability after high-level feature representation of convolutional operation. In this way, three variants of RULNet are constructed with health indicators, features with self-organizing map, or features with curve fitting. Ultimately, the proposed hybrid model is compared with the typical baseline models, including CNN and long short-term memory network (LSTM), through a practical reed relay dataset with two distinct degradation manners. The results from both degradation cases demonstrate that the proposed method outperforms CNN and LSTM regarding the index root mean squared error.  ( 3 min )

Non-reference speech quality models are important for a growing number of applications. The VoiceMOS 2022 challenge provided a dataset of synthetic voice conversion and text-to-speech samples with subjective labels. This study looks at the amount of variance that can be explained in subjective ratings of speech quality from metadata and the distribution imbalances of the dataset. Speech quality models were constructed using wav2vec 2.0 with additional metadata features that included rater groups and system identifiers and obtained competitive metrics including a Spearman rank correlation coefficient (SRCC) of 0.934 and MSE of 0.088 at the system-level, and 0.877 and 0.198 at the utterance-level. Using data and metadata that the test restricted or blinded further improved the metrics. A metadata analysis showed that the system-level metrics do not represent the model's system-level prediction as a result of the wide variation in the number of utterances used for each system on the validation and test datasets. We conclude that, in general, conditions should have enough utterances in the test set to bound the sample mean error, and be relatively balanced in utterance count between systems, otherwise the utterance-level metrics may be more reliable and interpretable.  ( 3 min )

With the freedom of communication provided in online social media, hate speech has increasingly generated. This leads to cyber conflicts affecting social life at the individual and national levels. As a result, hateful content classification is becoming increasingly demanded for filtering hate content before being sent to the social networks. This paper focuses on classifying hate speech in social media using multiple deep models that are implemented by integrating recent transformer-based language models such as BERT, and neural networks. To improve the classification performances, we evaluated with several ensemble techniques, including soft voting, maximum value, hard voting and stacking. We used three publicly available Twitter datasets (Davidson, HatEval2019, OLID) that are generated to identify offensive languages. We fused all these datasets to generate a single dataset (DHO dataset), which is more balanced across different labels, to perform multi-label classification. Our experiments have been held on Davidson dataset and the DHO corpora. The later gave the best overall results, especially F1 macro score, even it required more resources (time execution and memory). The experiments have shown good results especially the ensemble models, where stacking gave F1 score of 97% on Davidson dataset and aggregating ensembles 77% on the DHO dataset.  ( 2 min )

We present the joint contribution of IST and Unbabel to the WMT 2022 Shared Task on Quality Estimation (QE). Our team participated on all three subtasks: (i) Sentence and Word-level Quality Prediction; (ii) Explainable QE; and (iii) Critical Error Detection. For all tasks we build on top of the COMET framework, connecting it with the predictor-estimator architecture of OpenKiwi, and equipping it with a word-level sequence tagger and an explanation extractor. Our results suggest that incorporating references during pretraining improves performance across several language pairs on downstream tasks, and that jointly training with sentence and word-level objectives yields a further boost. Furthermore, combining attention and gradient information proved to be the top strategy for extracting good explanations of sentence-level QE models. Overall, our submissions achieved the best results for all three tasks for almost all language pairs by a considerable margin.  ( 2 min )

Twenty20 cricket, sometimes written Twenty-20, and often abbreviated to T20, is a short form of cricket. In a Twenty20 game the two teams of 11 players have a single innings each, which is restricted to a maximum of 20 overs. This version of cricket is especially unpredictable and is one of the reasons it has gained popularity over recent times. However, in this paper we try four different approaches for predicting the results of T20 Cricket Matches. Specifically we take in to account: previous performance statistics of the players involved in the competing teams, ratings of players obtained from reputed cricket statistics websites, clustering the players' with similar performance statistics and using an ELO based approach to rate players. We compare the performances of each of these approaches by using logistic regression, support vector machines, bayes network, decision tree, random forest.  ( 2 min )

Deep neural network (DNN) classifiers are vulnerable to adversarial attacks. Although the existing gradient-based attacks have achieved good performance in feed-forward model and image recognition tasks, the extension for time series classification in the recurrent neural network (RNN) remains a dilemma, because the cyclical structure of RNN prevents direct model differentiation and the visual sensitivity to perturbations of time series data challenges the traditional local optimization objective to minimize perturbation. In this paper, an efficient and widely applicable approach called TSFool for crafting high-quality adversarial time series for the RNN classifier is proposed. We propose a novel global optimization objective named Camouflage Coefficient to consider how well the adversarial samples hide in class clusters, and accordingly redefine the high-quality adversarial attack as a multi-objective optimization problem. We also propose a new idea to use intervalized weighted finite automata (IWFA) to capture deeply embedded vulnerable samples having otherness between features and latent manifold to guide the approximation to the optimization solution. Experiments on 22 UCR datasets are conducted to confirm that TSFool is a widely effective, efficient and high-quality approach with 93.22% less local perturbation, 32.33% better global camouflage, and 1.12 times speedup to existing methods.  ( 3 min )

Modern technologies are generating ever-increasing amounts of data. Making use of these data requires methods that are both statistically sound and computationally efficient. Typically, the statistical and computational aspects are treated separately. In this paper, we propose an approach to entangle these two aspects in the context of regularized estimation. Applying our approach to sparse and group-sparse regression, we show that it can improve on standard pipelines both statistically and computationally.  ( 2 min )

This paper considers parameter estimation for nonlinear state-space models, which is an important but challenging problem. We address this challenge by employing a variational inference (VI) approach, which is a principled method that has deep connections to maximum likelihood estimation. This VI approach ultimately provides estimates of the model as solutions to an optimisation problem, which is deterministic, tractable and can be solved using standard optimisation tools. A specialisation of this approach for systems with additive Gaussian noise is also detailed. The proposed method is examined numerically on a range of simulated and real examples focusing on the robustness to parameter initialisation; additionally, favourable comparisons are performed against state-of-the-art alternatives.  ( 2 min )

The mechanisms by which certain training interventions, such as increasing learning rates and applying batch normalization, improve the generalization of deep networks remains a mystery. Prior works have speculated that "flatter" solutions generalize better than "sharper" solutions to unseen data, motivating several metrics for measuring flatness (particularly $\lambda_{max}$, the largest eigenvalue of the Hessian of the loss); and algorithms, such as Sharpness-Aware Minimization (SAM) [1], that directly optimize for flatness. Other works question the link between $\lambda_{max}$ and generalization. In this paper, we present findings that call $\lambda_{max}$'s influence on generalization further into question. We show that: (1) while larger learning rates reduce $\lambda_{max}$ for all batch sizes, generalization benefits sometimes vanish at larger batch sizes; (2) by scaling batch size and learning rate simultaneously, we can change $\lambda_{max}$ without affecting generalization; (3) while SAM produces smaller $\lambda_{max}$ for all batch sizes, generalization benefits (also) vanish with larger batch sizes; (4) for dropout, excessively high dropout probabilities can degrade generalization, even as they promote smaller $\lambda_{max}$; and (5) while batch-normalization does not consistently produce smaller $\lambda_{max}$, it nevertheless confers generalization benefits. While our experiments affirm the generalization benefits of large learning rates and SAM for minibatch SGD, the GD-SGD discrepancy demonstrates limits to $\lambda_{max}$'s ability to explain generalization in neural networks.  ( 3 min )

Among the reasons that hinder the application of reinforcement learning (RL) to real-world problems, two factors are critical: limited data and the mismatch of the testing environment compared to training one. In this paper, we attempt to address these issues simultaneously with the problem setup of distributionally robust offline RL. Particularly, we learn an RL agent with the historical data obtained from the source environment and optimize it to perform well in the perturbed one. Moreover, we consider the linear function approximation to apply the algorithm to large-scale problems. We prove our algorithm can achieve the suboptimality of $O(1/\sqrt{K})$ depending on the linear function dimension $d$, which seems to be the first result with sample complexity guarantee in this setting. Diverse experiments are conducted to demonstrate our theoretical findings, showing the superiority of our algorithm against the non-robust one.  ( 2 min )

Despite the empirical successes of self-supervised learning (SSL) methods, it is unclear what characteristics of their representations lead to high downstream accuracies. In this work, we characterize properties that SSL representations should ideally satisfy. Specifically, we prove necessary and sufficient conditions such that for any task invariant to given data augmentations, desired probes (e.g., linear or MLP) trained on that representation attain perfect accuracy. These requirements lead to a unifying conceptual framework for improving existing SSL methods and deriving new ones. For contrastive learning, our framework prescribes simple but significant improvements to previous methods such as using asymmetric projection heads. For non-contrastive learning, we use our framework to derive a simple and novel objective. Our resulting SSL algorithms outperform baselines on standard benchmarks, including SwAV+multicrops on linear probing of ImageNet.  ( 2 min )

We study the problem of estimating an unknown parameter in a distributed and online manner. Existing work on distributed online learning typically either focuses on asymptotic analysis, or provides bounds on regret. However, these results may not directly translate into bounds on the error of the learned model after a finite number of time-steps. In this paper, we propose a distributed online estimation algorithm which enables each agent in a network to improve its estimation accuracy by communicating with neighbors. We provide non-asymptotic bounds on the estimation error, leveraging the statistical properties of the underlying model. Our analysis demonstrates a trade-off between estimation error and communication costs. Further, our analysis allows us to determine a time at which the communication can be stopped (due to the costs associated with communications), while meeting a desired estimation accuracy. We also provide a numerical example to validate our results.  ( 2 min )

Helmholtz Machines (HMs) are a class of generative models composed of two Sigmoid Belief Networks (SBNs), acting respectively as an encoder and a decoder. These models are commonly trained using a two-step optimization algorithm called Wake-Sleep (WS) and more recently by improved versions, such as Reweighted Wake-Sleep (RWS) and Bidirectional Helmholtz Machines (BiHM). The locality of the connections in an SBN induces sparsity in the Fisher Information Matrices associated to the probabilistic models, in the form of a finely-grained block-diagonal structure. In this paper we exploit this property to efficiently train SBNs and HMs using the natural gradient. We present a novel algorithm, called Natural Reweighted Wake-Sleep (NRWS), that corresponds to the geometric adaptation of its standard version. In a similar manner, we also introduce Natural Bidirectional Helmholtz Machine (NBiHM). Differently from previous work, we will show how for HMs the natural gradient can be efficiently computed without the need of introducing any approximation in the structure of the Fisher information matrix. The experiments performed on standard datasets from the literature show a consistent improvement of NRWS and NBiHM not only with respect to their non-geometric baselines but also with respect to state-of-the-art training algorithms for HMs. The improvement is quantified both in terms of speed of convergence as well as value of the log-likelihood reached after training.  ( 3 min )

Supervised classification techniques use training samples to learn a classification rule with small expected 0-1 loss (error probability). Conventional methods enable tractable learning and provide out-of-sample generalization by using surrogate losses instead of the 0-1 loss and considering specific families of rules (hypothesis classes). This paper presents minimax risk classifiers (MRCs) that minimize the worst-case 0-1 loss over general classification rules and provide tight performance guarantees at learning. We show that MRCs are strongly universally consistent using feature mappings given by characteristic kernels. The paper also proposes efficient optimization techniques for MRC learning and shows that the methods presented can provide accurate classification together with tight performance guarantees in practice.  ( 2 min )

Stochastic processes provide a mathematically elegant way model complex data. In theory, they provide flexible priors over function classes that can encode a wide range of interesting assumptions. In practice, however, efficient inference by optimisation or marginalisation is difficult, a problem further exacerbated with big data and high dimensional input spaces. We propose a novel variational autoencoder (VAE) called the prior encoding variational autoencoder ($\pi$VAE). The $\pi$VAE is finitely exchangeable and Kolmogorov consistent, and thus is a continuous stochastic process. We use $\pi$VAE to learn low dimensional embeddings of function classes. We show that our framework can accurately learn expressive function classes such as Gaussian processes, but also properties of functions to enable statistical inference (such as the integral of a log Gaussian process). For popular tasks, such as spatial interpolation, $\pi$VAE achieves state-of-the-art performance both in terms of accuracy and computational efficiency. Perhaps most usefully, we demonstrate that the low dimensional independently distributed latent space representation learnt provides an elegant and scalable means of performing Bayesian inference for stochastic processes within probabilistic programming languages such as Stan.  ( 3 min )

We propose a Langevin diffusion-based algorithm for non-convex optimization and sampling on a product manifold of spheres. Under a logarithmic Sobolev inequality, we establish a guarantee for finite iteration convergence to the Gibbs distribution in terms of Kullback--Leibler divergence. We show that with an appropriate temperature choice, the suboptimality gap to the global minimum is guaranteed to be arbitrarily small with high probability. As an application, we consider the Burer--Monteiro approach for solving a semidefinite program (SDP) with diagonal constraints, and analyze the proposed Langevin algorithm for optimizing the non-convex objective. In particular, we establish a logarithmic Sobolev inequality for the Burer--Monteiro problem when there are no spurious local minima, but under the presence saddle points. Combining the results, we then provide a global optimality guarantee for the SDP and the Max-Cut problem. More precisely, we show that the Langevin algorithm achieves $\epsilon$ accuracy with high probability in $\widetilde{\Omega}( \epsilon^{-5} )$ iterations.  ( 2 min )

We propose a non-asymptotic convergence analysis of a two-step approach to learn a conditional value-at-risk (VaR) and expected shortfall (ES) in a nonparametric setting using Rademacher and Vapnik-Chervonenkis bounds. Our approach for the VaR is extended to the problem of learning at once multiple VaRs corresponding to different quantile levels. This results in efficient learning schemes based on neural network quantile and least-squares regressions. An a posteriori Monte Carlo (non-nested) procedure is introduced to estimate distances to the ground-truth VaR and ES without access to the latter. This is illustrated using numerical experiments in a Gaussian toy-model and a financial case-study where the objective is to learn a dynamic initial margin.  ( 2 min )

We study representations of data from an arbitrary metric space $\mathcal{X}$ in the space of univariate Gaussian mixtures with a transport metric (Delon and Desolneux 2020). We derive embedding guarantees for feature maps implemented by small neural networks called \emph{probabilistic transformers}. Our guarantees are of memorization type: we prove that a probabilistic transformer of depth about $n\log(n)$ and width about $n^2$ can bi-H\"{o}lder embed any $n$-point dataset from $\mathcal{X}$ with low metric distortion, thus avoiding the curse of dimensionality. We further derive probabilistic bi-Lipschitz guarantees which trade off the amount of distortion and the probability that a randomly chosen pair of points embeds with that distortion. If $\mathcal{X}$'s geometry is sufficiently regular, we obtain stronger, bi-Lipschitz guarantees for all points in the dataset. As applications we derive neural embedding guarantees for datasets from Riemannian manifolds, metric trees, and certain types of combinatorial graphs.  ( 2 min )

Single-cell RNA-seq datasets are growing in size and complexity, enabling the study of cellular composition changes in various biological/clinical contexts. Scalable dimensionality reduction techniques are in need to disentangle biological variation in them, while accounting for technical and biological confounders. In this work, we extend a popular approach for probabilistic non-linear dimensionality reduction, the Gaussian process latent variable model, to scale to massive single-cell datasets while explicitly accounting for technical and biological confounders. The key idea is to use an augmented kernel which preserves the factorisability of the lower bound allowing for fast stochastic variational inference. We demonstrate its ability to reconstruct latent signatures of innate immunity recovered in Kumasaka et al. (2021) with 9x lower training time. We further analyze a COVID dataset and demonstrate across a cohort of 130 individuals, that this framework enables data integration while capturing interpretable signatures of infection. Specifically, we explore COVID severity as a latent dimension to refine patient stratification and capture disease-specific gene expression.  ( 2 min )

Spectral embedding finds vector representations of the nodes of a network, based on the eigenvectors of its adjacency or Laplacian matrix, and has found applications throughout the sciences. Many such networks are multipartite, meaning their nodes can be divided into groups and nodes of the same group are never connected. When the network is multipartite, this paper demonstrates that the node representations obtained via spectral embedding live near group-specific low-dimensional subspaces of a higher-dimensional ambient space. For this reason we propose a follow-on step after spectral embedding, to recover node representations in their intrinsic rather than ambient dimension, proving uniform consistency under a low-rank, inhomogeneous random graph model. Our method naturally generalizes bipartite spectral embedding, in which node representations are obtained by singular value decomposition of the biadjacency or bi-Laplacian matrix.  ( 2 min )

Model-based recursive partitioning (MOB) is a semi-parametric statistical approach allowing the identification of subgroups that can be combined with a broad range of outcome measures including continuous time-to-event outcomes. When time is measured on a discrete scale, methods and models need to account for this discreetness as otherwise subgroups might be spurious and effects biased. The test underlying the splitting criterion of MOB, the M-fluctuation test, assumes independent observations. However, for fitting discrete time-to-event models the data matrix has to be modified resulting in an augmented data matrix violating the independence assumption. We propose MOB for discrete Survival data (MOB-dS) which controls the type I error rate of the test used for data splitting and therefore the rate of identifying subgroups although none is present. MOB-ds uses a permutation approach accounting for dependencies in the augmented time-to-event data to obtain the distribution under the null hypothesis of no subgroups being present. Through simulations we investigate the type I error rate of the new MOB-dS and the standard MOB for different patterns of survival curves and event rates. We find that the type I error rates of the test is well controlled for MOB-dS, but observe some considerable inflations of the error rate for MOB. To illustrate the proposed methods, MOB-dS is applied to data on unemployment duration.  ( 2 min )

Given a dataset, features (binary values per feature) and a set of multiple labels (single label per entity), I can train a model to classify incoming data to a single label. But let's say I want to classify incoming data that is a mixture of two labels. Imagine if we took the binary features of one sample and just performed an "OR" operation with a second sample. And we want to find out the two most likely labels that were mixed. On first glance, this might seem like a multi-label classification problem. However, the training data are single label entities. Will training a multi-label model on single label entities give me the ability to classify mixtures? An alternative, brute force method might be to transform my single label entities into all possible pair-wise combinations and train based on the pair-wise mixture dataset? Are there existing solutions for this? Any input would be greatly appreciated. submitted by /u/daemonk [link] [comments]  ( 89 min )

Data-centric AI doesn't just stop with cleaning and preparing data for model training - there are rich insights to be gleaned from production data. By analyzing, segmenting, and selectively re-labeling your production inference data, you can generate datasets for future model retraining. This talk will show you how you can use human-in-the-loop oversight to generate high-quality, labeled datasets from your prediction data for future model retraining. Tune in on Sept 22nd at 12:30 PM EDT. submitted by /u/modzykirsten [link] [comments]  ( 89 min )

I have a scenario where I will be modeling many different parts on many different machines using IoT sensor data. That alone is going to be a large amount of models. However, an added feature (that I was not told about) will be a list of questions that will be asked of the users on top of the fully automated sensor data. The idea is to raise an alert when a part might be malfunctioning, then ask the user a list of questions that cannot be found via existing sensors and give them an updated score. My question is: is there a way to incorporate this large chunk of missing data coming from the questions into the models (there will be a fair amount of test cases where no questions have been asked), or will I have to perform at least two models for each part (i.e. a model without the questions answered and a model with questions answered)? I know that I cannot just simply use the questions as is in the model because there would be a HUGE correlation between the question variables. I can probably impute those missing question values using a number of techniques, but I've never done that and am not sure how this will affect the model's output. Thanks in advance for any advice/recommendations! submitted by /u/the_planes_walker [link] [comments]  ( 89 min )

[R] I am working on research project using BAT algorithm with Feed Forward Neural Networks. I want to know that there are many fitness functions available for these algorithms, how we select a fitness function for our work. Means what makes a fitness function suitable for a problem. ​ I have done all of the other work for my project, the only confusion is the fitness function involved. ​ I have read papers of other researchers using Meta heuristics algorithms, but they even don't discuss the fitness function used. submitted by /u/Horseman099 [link] [comments]  ( 88 min )

Good day, may I ask if anyone knows the current state of the art for clustering algorithms. While searching I only found variations of DBSCAN and Gaussian Mixture Models. Are these two still relevant or are there newer approaches used in the industry? I have some driving data to work with and I'm currently planning to do a comparison of various clustering algorithms with SVM, PCA, ANN's and more. Thank you :) submitted by /u/aswd1908 [link] [comments]  ( 89 min )

Hi everyone, I'm finishing my MSc in Data Science, specialising in NLP and Social Network Analysis. I'd like to improve my skills and enrich my CV with a bunch of extra projects, preferably in NLP. Could you suggest me some sites where I can apply? Thank you. submitted by /u/Similar-Year4215 [link] [comments]  ( 88 min )

Pretty Jupyter is an easy-to-use package that creates beautifully styled and dynamic html webpage from Jupyter notebook. Its repo is available here: https://github.com/JanPalasek/pretty-jupyter . Check out the demo and compare it with the default jupyter. You can try also Pretty Jupyter online without the need to install it. Main Features Visually appealing styles. Table of Contents can be automatically generated. Using Python variables in Markdown. Tabsets for hiding section content behind clickable tabs. Code Folding: Show/Hide code to filter out unnecessary content. Themes: Selection from a wide variaty of available themes. Wide range of configuration options with sensible defaults. Unobtrusive syntax that works well in notebook environments. Everything is integrated via JavaScript in the output web-page, so no Python kernel running in the background is needed. Whats new in 2.0? Wide range of notebook-level metadata to customize the default output. For example we can turn off inputs. Cell-level metadata to override various settings on the cell level (e.g. we can remove individual cells from the output). For example an input can be turned off in one cell, while generally being turned off in the notebook. Overriding all notebook-level metadata from command-line. Wide range of integrated themes. Easier syntax. New design. New wide range of examples. submitted by /u/Jan2579 [link] [comments]  ( 102 min )

Hi everyone, Our team has built an automated Speech Recognition service that generates subtitle files for any video or audio file and can translate into 45+ languages. It's powered fully by Deep Learning and beats other implementations like YouTube captions. If you'd like to try it with your own content, it's free to create an account and use. Learn more about it here: https://www.smartmine.net/video-services/subtitling-description Try it free here: https://ai.smartmine.net/service/speech-recognition/captioning It has some great features like: Accurate subtitles powered by DL Speech recognition in 11 languages DL-powered translation into 45+ languages Multiple speaker recognition Subtitle editor to fine-tune results We're a small company, so we would really appreciate any feedback you have! submitted by /u/aL_eX49 [link] [comments]  ( 90 min )

Hello, At the moment i am implementing YOLOv5 on a flask server which is working. But now i want to use the detected objects in a function to process the detected objects and send the result in realtime to a react frontend. For this I am using a the moment SSE but it is very slow. Therefore I would like to have a faster solution. It would be nice if someone could help me. submitted by /u/stoemb- [link] [comments]  ( 89 min )

I am about to conduct a systematic review, in short: convolutional neural networks (CNNs) used for neuroradiology (CT imaging) and their relevance/prospects for clinical use. Developing a scientific reproducible search protocol for finding relevant papers on CNNs applied to CT imaging has turned out tricky. How to semantically and scientifically define "CNN architecture" when the variety of models, (sometimes overlapping) terms and 'nicknames' for different solutions is vast and ever-expanding? The search requires unambiguous definitions. "Convolut*/ConvNet/CNN" as search terms/keywords for "convolutional (NNs)" >> I am afraid is not a wide enough scope as convolution operations are used in various ML models, and spelling out "convolutional (neural network)" is not done but considered obvious? As I am not familiar with all existing backbone convolution networks and their names (ShuffleNet, Inception, GoogLeNet etc), it is impossible to systematically add them all to the search protocol. Inclusion and exclusion criteria based on algorithm details is hard: Consulting full texts for details, convolution/CNN/ConvNet is not necessarily explicitly stated: a quick Cntrl+F: "conv" doesn't catch a thing. However, the algorithm used may be mentioned by its name e.g. AlexNet, ResNet, some of which are often (?) at least partly convolution-based. The AI tree gets a bit messy at the level of CNNs: RNNs, ResNets, AEs, GANs, TransfLearn... Methods and terminology overlap and evolve constantly. Where do I draw the lines for CNNs. I cannot afford consulting the code, I must rely on text descriptions. The problem is the number of papers which makes it almost impossible to go through in such detail to understand the model architecture. Automation for keyword hunting is also hard, as I don't have a set of all possible CNN keywords. I am a medic and my abilities in understanding ML terminology are clearly limited. Any ideas? submitted by /u/Ok-Professional-6788 [link] [comments]  ( 94 min )

What is THUNET? A deep learning net/framework named "TsingHua University NET", short for "THUNET", is for non-commercial, educational, scientific purpose for the deep learning community. How to build a neural network with THUNET? Next, I will explain how to use THUNET to save and load a model. Models are saved in 7z format, thus gain higher compression rate than zip format by 10%+.Zip / 7zip Compression Differences Tutorial-3: Model Saving and Loading Model serialization makes use of the 7z format instead of the legacy zip format for higher compression rate. Referred from Wiki article on comparison of zip and 7z In 2011, TopTenReviews found that the 7z compression was at least 17% better than ZIP,[15] and 7-Zip's own site has since 2002 reported that while compression ratio results …  ( 92 min )

Hi everyone, I am currently doing a research regarding this idea, and was wondering if anyone has any suggestions or advice that I could further look into. Imagine that I have 2 ground truths available, let’s call them y1 and y2. y1 is very good at doing A, whereas y2 is better at doing B. y1 is bad at B, and y2 is bad at A. Does anyone have any idea how I can have a model that can give me a single output, that make use of both y1 and y2 such that the final output is good at both A and B? All the variables are continuous, can also be considered as images. I was thinking along the ways of multi-task learning, or having a combination of loss functions into 1 single loss, but I am still stumped on what’s the best way going forward. Some advice would be beneficial. Thanks submitted by /u/plsendfast [link] [comments]  ( 90 min )

Hi! I've written an article which explores TabTransformer, in particular how the multi-headed attention can be applied to the categorical variables. Here's the link if you're interested in finding out more. The main idea is quite simple - to use Transformer blocks to contextualise categorical embeddings. These embeddings are then concatenated with numerical features and passed to MLP to make a prediction. How well does it work? It turns out that the addition of Transformer blocks with multi-headed attention layers can significantly improve the MLP's performance (but it still underperforms compared to GBDTs). TabTransformer To simplify the usage of the model, I've started working on TabTransformerTF package, but it's still WIP so feel free to report issues when you find some. Also, to showcase the use of the package, I've participated in the last month's tabular playground and got into top 35% with this notebook. Not great, but also not terrible given that the dataset was quite small and messy. submitted by /u/blessedorcursed [link] [comments]  ( 89 min )

Hey all, I am sharing a deep learning docker image that can be used to save you time setting up a new deep learning system. It gas PyTorch, TensorFlow, Pandas, Numpy, Scipy, Matplotlib, and many more common packages installed and configured. please visit: matifali/DockerDL: Deep Learning Docker Image (github.com) Feel free to create issues or PRs, if you face problems or have valuable feedback. submitted by /u/tech_geeky [link] [comments]  ( 88 min )

NeurIPS 2022 paper acceptance results are supposed to be released at 1pm (PDT) on September 14. I thought to create a discussion thread for us to countdown and discuss any celebration/issue/complain/feedback or anything else. There is so much noise in the reviews every year. Some good work that the authors are proud of might get rejected because of the noisy system, given that NeurIPS is growing so large these years. We should keep in mind that the work is still valuable no matter what the final result is. ---------------- PS: More than 150 people are looking at this thread at 1:30pm PDT (on September 14). That's quite a lot. https://preview.redd.it/fxgrk4vjyvn91.png?width=913&format=png&auto=webp&s=8d58e76fd9996f4650d5cdd6ce1d2e5bdf9b0245 submitted by /u/zy415 [link] [comments]  ( 109 min )

Who here are convinced that they have a really good setup that keeps track of their ML experiments? What is your setup (what tools / practices etc.)? Flex on me -- I just genuinely want to know all the possibilities of good ML experiment tracking practices. submitted by /u/glai9665 [link] [comments]  ( 97 min )

Came across the proceedings from this conference, and I thought the papers therein would be of interesting to people here. One that stood out to me was Partial Identification with Noisy Covariates: A Robust Optimization Approach. submitted by /u/bikeskata [link] [comments]  ( 88 min )

I have a large time series dataset were some people get flagged manually for being at risk for an outcome and others automatically by the system. However these two methods end up missing a large number of people. I want to try to identify similar rows in the data using the information I have from rows of manually and automatically flagged people. It's not a fraud detection problem but I was thinking of looking at those methods for ideas since I feel like it could be somewhat similar. I'm thinking that I need to to build a model to train it on the labeled rows and then use it to predict unlabeled rows in the data. References and suggestions would be greatly appreciated. I'm hoping to just be pointed in the right direction. submitted by /u/SomaDomaBoma [link] [comments]  ( 89 min )

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Data-centric AI doesn't just stop with cleaning and preparing data for model training - there are rich insights to be gleaned from production data. By analyzing, segmenting, and selectively re-labeling your production inference data, you can generate datasets for future model retraining. This talk will show you how you can use human-in-the-loop oversight to generate high-quality, labeled datasets from your prediction data for future model retraining. Tune in on Sept 22nd at 12:30 PM EDT. submitted by /u/modzykirsten [link] [comments]  ( 88 min )

is there an AI that can change pre existing text based on a theme/prompt? a random example: if i gave it a paragraph from Lord of the rings but i wanted Frodo to be Donald duck can GPT-3 do this? or any others submitted by /u/Specialist_Village_5 [link] [comments]  ( 87 min )

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For years, teachers have struggled to help every student with their individualized educational needs. This gets, even more, tougher in a class of twenty, thirty, or forty students in which every student has to pass through the same tests, irrespective of the student's personalized needs. That said, the schoolrooms of today have not changed much in the past 50 years. Students sit in a room together and complete the same lessons—typically using the same textbooks—no matter their learning skills or expertise in a particular subject. Some students get left behind. Others are left unchallenged and bored by this one-size-for-all approach. AI could do all this now. AI today is helping teachers in creating a series of smart content programs and intelligent tutoring systems that help students learn in a more customized approach. Students will be able to learn new things in a much better way with advanced tutor apps. Such apps can become education mentors for students and provide engaging learning opportunities.AI can now track the performance of an individual student based on his previous grades, participation, and performances and help a student realize his maximum potential. The rest of this article covers some ways in which AI is making education smarter, cheaper, and more accessible to all: AI as a tutor AI can automate grading AI can provide cognitive insights in classrooms AI can improve the education system Read more.... https://owlcation.com/academia/4-Amazing-Benefits-of-Artificial-Intelligence-in-Schools submitted by /u/IcyCartoonist1955 [link] [comments]  ( 89 min )

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So I've seen upscaling (video or image) AIs, AIs that increase FPS, AIs that transfer facial or body movements, AIs that transfer clothes. What're some other "useful" AI? submitted by /u/Got70Types0fMalware [link] [comments]  ( 90 min )

How do I increase of decrease scale ratio? How do I activae TTA? How does title size work? How do I covert bathes of images? submitted by /u/Got70Types0fMalware [link] [comments]  ( 87 min )

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I'm new to MARL and I'm looking for some open source implementations that I could use in a project. I have some previous experience in single agent RL, mainly with SB3 and gym, but just now started reading some MARL papers. I'm mainly looking for a good balance between performance, good documentation and ease of use. So far, I've taken look at Mava and RLlib. Mava seems like a very complete option, though I'm not at all familiar with the API and it maybe something simpler could also do the trick. As for the environment library, I was considering PettingZoo, since it has a very similar api to gym. Thought I might as well ask here first, as people can suggest other options for me to investigate or even give me some pros and cons they have learned from past experience. submitted by /u/Ok_Signature_4944 [link] [comments]  ( 88 min )

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SpaceRobotEnv is an open-sourced environments for trajectory planning of free-floating space robots. Reaching high-level planning accuracy, bimanual coordination and end-to-end control remains an open challenge for space robotics researchers. To better help the community study this problem, SpaceRobotEnv are developed with the following key features: Real Space Environment; Dynamic coupling control; Image input. URL: https://github.com/Tsinghua-Space-Robot-Learning-Group/SpaceRobotEnv. Note: our repo can be found in the OpenAI Gym Documentation now. Please see SpaceRobotEnv. Hope everyone enjoy it! https://reddit.com/link/xe3e54/video/u92i2yqg3un91/player submitted by /u/Shengjie_Wang [link] [comments]  ( 100 min )

I'm looking at this code (https://github.com/marlbenchmark/on-policy/blob/c662b377694bd0311b760ff1501384a424b90b24/onpolicy/algorithms/r_mappo/algorithm/r_actor_critic.py#L72) and there's something I don't understand. As far as I understand, a PPO update consists of taking a batch of previous observations, actions, etc, so as to do action evaluation and give three things as outputs: 1 A value 2 Actions log probs 3 Action entropies Say the observation is an image. What I don't understand is how this is gonna work if the inputs consists of multiple images stacked together. The agent is gonna receive all these images and... How does this make sense? I'm sure someone can help me understand. Thanks! submitted by /u/No_Possibility_7588 [link] [comments]  ( 88 min )

Is it possible to get reward if my value should be changing like sin/cos? For example, i know that value should be like sin/cos ( should rise and then down), but i cannot tell exact numbers,its should be like sin wave on graph, so there must be min then max, then min etc . I know how to achieve exact number, but how to check is my value behaves like sin/cos? is there any reward solution for this type of tasks? P.S is there some resources for reward design ideas? submitted by /u/IndependenceCivil576 [link] [comments]  ( 89 min )

Amazon Lex is a service for building conversational interfaces using voice and text. Amazon Lex provides high-quality speech recognition and language understanding capabilities. With Amazon Lex, you can add sophisticated, natural language bots to new and existing applications. Amazon Lex reduces multi-platform development efforts, allowing you to easily publish your speech or text chatbots to […]  ( 8 min )